Details of the Target

General Information of Target

Target ID LDTP02205
Target Name Tubulin beta chain (TUBB)
Gene Name TUBB
Gene ID 203068
Synonyms
TUBB5; Tubulin beta chain; Tubulin beta-5 chain
3D Structure
Download
2D Sequence (FASTA)
Download
3D Structure (PDB)
Download
Sequence
MREIVHIQAGQCGNQIGAKFWEVISDEHGIDPTGTYHGDSDLQLDRISVYYNEATGGKYV
PRAILVDLEPGTMDSVRSGPFGQIFRPDNFVFGQSGAGNNWAKGHYTEGAELVDSVLDVV
RKEAESCDCLQGFQLTHSLGGGTGSGMGTLLISKIREEYPDRIMNTFSVVPSPKVSDTVV
EPYNATLSVHQLVENTDETYCIDNEALYDICFRTLKLTTPTYGDLNHLVSATMSGVTTCL
RFPGQLNADLRKLAVNMVPFPRLHFFMPGFAPLTSRGSQQYRALTVPELTQQVFDAKNMM
AACDPRHGRYLTVAAVFRGRMSMKEVDEQMLNVQNKNSSYFVEWIPNNVKTAVCDIPPRG
LKMAVTFIGNSTAIQELFKRISEQFTAMFRRKAFLHWYTGEGMDEMEFTEAESNMNDLVS
EYQQYQDATAEEEEDFGEEAEEEA
Target Bioclass
Other
Family
Tubulin family
Subcellular location
Cytoplasm, cytoskeleton
Function
Tubulin is the major constituent of microtubules, a cylinder consisting of laterally associated linear protofilaments composed of alpha- and beta-tubulin heterodimers. Microtubules grow by the addition of GTP-tubulin dimers to the microtubule end, where a stabilizing cap forms. Below the cap, tubulin dimers are in GDP-bound state, owing to GTPase activity of alpha-tubulin.
Uniprot ID
P07437
Ensemble ID
ENST00000327892.13
HGNC ID
HGNC:20778
ChEMBL ID
CHEMBL5444

Probe(s) Labeling This Target

ABPP Probe
Click To Hide/Show 64 Probe Related to This Target
Probe name Structure Binding Site(Ratio) Interaction ID Ref
m-APA
 Probe Info  		15.00  LDD0402  [1]
P1
 Probe Info  		1.62  LDD0452  [2]
P8
 Probe Info  		1.64  LDD0451  [2]
A-EBA
 Probe Info  		3.96  LDD0215  [3]
AZ-5
 Probe Info  		2.44  LDD0394  [4]
CHEMBL5175495
 Probe Info  		6.75  LDD0196  [5]
CY4
 Probe Info  		3.50  LDD0244  [6]
N1
 Probe Info  		6.79  LDD0242  [6]
TH211
 Probe Info  		Y208(20.00); Y281(20.00); Y59(20.00); Y106(17.63)  LDD0257  [7]
TH214
 Probe Info  		Y310(20.00); Y36(20.00); Y50(20.00); Y51(20.00)  LDD0258  [7]
TH216
 Probe Info  		Y106(20.00); Y159(20.00); Y208(20.00); Y310(20.00)  LDD0259  [7]
YN-1
 Probe Info  		100.00  LDD0444  [8]
YN-4
 Probe Info  		100.00  LDD0445  [8]
ONAyne
 Probe Info  		K58(0.00); K297(0.00)  LDD0273  [9]
OPA-S-S-alkyne
 Probe Info  		K58(2.92)  LDD3494  [10]
Probe 1
 Probe Info  		Y36(9.10); Y50(250.94); Y51(220.54); Y106(15.74)  LDD3495  [11]
P26
 Probe Info  		2.25  LDD0409  [12]
JZ128-DTB
 Probe Info  		C201(0.00); C354(0.00); C12(0.00)  LDD0462  [13]
THZ1-DTB
 Probe Info  		C12(1.04)  LDD0460  [13]
AZ-9
 Probe Info  		10.00  LDD2154  [4]
AHL-Pu-1
 Probe Info  		C129(2.47); C303(2.15)  LDD0168  [14]
HPAP
 Probe Info  		5.79  LDD0062  [15]
EA-probe
 Probe Info  		N.A.  LDD0440  [16]
HHS-482
 Probe Info  		Y106(0.87); Y159(0.84); Y183(0.83); Y200(1.00)  LDD0285  [17]
HHS-475
 Probe Info  		Y222(0.69); Y50(0.75); Y310(0.76); Y106(0.78)  LDD0264  [18]
HHS-465
 Probe Info  		Y106(10.00); Y159(9.41); Y183(10.00); Y200(3.29)  LDD2237  [19]
DBIA
 Probe Info  		C127(2.14); C129(2.14)  LDD0080  [20]
5E-2FA
 Probe Info  		N.A.  LDD2235  [21]
AMP probe
 Probe Info  		N.A.  LDD0200  [22]
ATP probe
 Probe Info  		K58(0.00); K252(0.00); K336(0.00); K324(0.00)  LDD0199  [22]
4-Iodoacetamidophenylacetylene
 Probe Info  		C303(0.00); C127(0.00); C129(0.00); C12(0.00)  LDD0038  [23]
IA-alkyne
 Probe Info  		C239(0.00); C354(0.00); C303(0.00); C12(0.00)  LDD0032  [24]
IPIAA_H
 Probe Info  		C12(0.00); C239(0.00); C127(0.00); C303(0.00)  LDD0030  [25]
IPIAA_L
 Probe Info  		C354(0.00); C239(0.00); C303(0.00); C129(0.00)  LDD0031  [25]
Lodoacetamide azide
 Probe Info  		C303(0.00); C127(0.00); C129(0.00); C12(0.00)  LDD0037  [23]
2PCA
 Probe Info  		N.A.  LDD0034  [26]
ATP probe
 Probe Info  		K362(0.00); K379(0.00); K297(0.00); K336(0.00)  LDD0035  [27]
BTD
 Probe Info  		N.A.  LDD0004  [28]
JW-RF-010
 Probe Info  		C129(0.00); C12(0.00); C239(0.00); C354(0.00)  LDD0026  [29]
NAIA_4
 Probe Info  		C12(0.00); C303(0.00)  LDD2226  [30]
TFBX
 Probe Info  		C239(0.00); C129(0.00); C12(0.00); C354(0.00)  LDD0027  [29]
WYneC
 Probe Info  		C12(0.00); C354(0.00)  LDD0014  [28]
WYneO
 Probe Info  		C354(0.00); C12(0.00); C303(0.00)  LDD0022  [28]
1d-yne
 Probe Info  		K216(0.00); K362(0.00); K252(0.00); K103(0.00)  LDD0356  [31]
ENE
 Probe Info  		C354(0.00); C12(0.00); C303(0.00)  LDD0006  [28]
IPM
 Probe Info  		C12(0.00); C303(0.00); C129(0.00); C239(0.00)  LDD0005  [28]
NHS
 Probe Info  		K58(0.00); K379(0.00); K336(0.00); K324(0.00)  LDD0010  [28]
OSF
 Probe Info  		Y50(0.00); H105(0.00); Y310(0.00); H264(0.00)  LDD0029  [32]
PF-06672131
 Probe Info  		C303(0.00); C354(0.00)  LDD0017  [33]
SF
 Probe Info  		Y281(0.00); Y50(0.00); Y222(0.00); Y340(0.00)  LDD0028  [32]
STPyne
 Probe Info  		K297(0.00); K19(0.00); K324(0.00); K252(0.00)  LDD0009  [28]
VSF
 Probe Info  		C129(0.00); C127(0.00); C239(0.00); C12(0.00)  LDD0007  [28]
Phosphinate-6
 Probe Info  		C127(0.00); C201(0.00); C12(0.00); C211(0.00)  LDD0018  [34]
Ox-W18
 Probe Info  		N.A.  LDD2175  [35]
1c-yne
 Probe Info  		K324(0.00); C127(0.00); K336(0.00); K216(0.00)  LDD0228  [31]
Acrolein
 Probe Info  		H28(0.00); H37(0.00)  LDD0217  [36]
Crotonaldehyde
 Probe Info  		H28(0.00); H37(0.00)  LDD0219  [36]
Methacrolein
 Probe Info  		N.A.  LDD0218  [36]
W1
 Probe Info  		C239(0.00); C303(0.00); C354(0.00); K252(0.00)  LDD0236  [37]
AOyne
 Probe Info  		15.00  LDD0443  [38]
MPP-AC
 Probe Info  		N.A.  LDD0428  [39]
NAIA_5
 Probe Info  		C303(0.00); C12(0.00)  LDD2223  [30]
TER-AC
 Probe Info  		N.A.  LDD0426  [39]
THL-R
 Probe Info  		N.A.  LDD0077  [40]
PAL-AfBPP Probe
Click To Hide/Show 34 Probe Related to This Target
Probe name Structure Binding Site(Ratio) Interaction ID Ref
C018
 Probe Info  		6.36  LDD1726  [41]
C049
 Probe Info  		8.46  LDD1747  [41]
C153
 Probe Info  		18.64  LDD1834  [41]
C159
 Probe Info  		25.63  LDD1839  [41]
C198
 Probe Info  		59.71  LDD1874  [41]
C212
 Probe Info  		5.62  LDD1886  [41]
C213
 Probe Info  		18.00  LDD1887  [41]
C218
 Probe Info  		12.38  LDD1892  [41]
C264
 Probe Info  		78.79  LDD1935  [41]
C270
 Probe Info  		8.82  LDD1940  [41]
C287
 Probe Info  		22.32  LDD1957  [41]
C305
 Probe Info  		9.92  LDD1974  [41]
C349
 Probe Info  		11.63  LDD2010  [41]
C363
 Probe Info  		18.13  LDD2024  [41]
C378
 Probe Info  		6.82  LDD2037  [41]
C382
 Probe Info  		21.11  LDD2041  [41]
C390
 Probe Info  		32.00  LDD2049  [41]
C413
 Probe Info  		17.75  LDD2069  [41]
C420
 Probe Info  		10.78  LDD2075  [41]
C424
 Probe Info  		11.71  LDD2079  [41]
FFF probe11
 Probe Info  		19.45  LDD0472  [42]
FFF probe12
 Probe Info  		8.06  LDD0473  [42]
FFF probe13
 Probe Info  		10.22  LDD0475  [42]
FFF probe3
 Probe Info  		10.82  LDD0464  [42]
FFF probe6
 Probe Info  		9.76  LDD0467  [42]
JN0003
 Probe Info  		10.22  LDD0469  [42]
VE-P
 Probe Info  		N.A.  LDD0396  [43]
A-DA
 Probe Info  		2.39  LDD0143  [44]
Diazir
 Probe Info  		Y51(0.00); E53(0.00); C12(0.00)  LDD0011  [28]
LD-F
 Probe Info  		S25(0.00); D31(0.00); E27(0.00)  LDD0015  [45]
Photocelecoxib
 Probe Info  		E69(0.00); E288(0.00)  LDD0019  [46]
Photoindomethacin
 Probe Info  		E288(0.00); V286(0.00); K297(0.00); D295(0.00)  LDD0155  [46]
OEA-DA
 Probe Info  		5.71  LDD0046  [47]
STS-1
 Probe Info  		N.A.  LDD0068  [48]

Competitor(s) Related to This Target

Competitor ID Name Cell line Binding Site(Ratio) Interaction ID Ref
 LDCM0502  1-(Cyanoacetyl)piperidine MDA-MB-231 C354(0.66); C12(0.63)  LDD2095  [49]
 LDCM0537  2-Cyano-N,N-dimethylacetamide MDA-MB-231 C354(0.92); C12(0.89)  LDD2130  [49]
 LDCM0558  2-Cyano-N-phenylacetamide MDA-MB-231 C354(1.30)  LDD2152  [49]
 LDCM0025  4SU-RNA HEK-293T C129(2.47); C303(2.15)  LDD0168  [14]
 LDCM0214  AC1 HEK-293T C127(1.02)  LDD0812  [20]
 LDCM0215  AC10 HEK-293T C127(1.23)  LDD0813  [20]
 LDCM0216  AC100 HEK-293T C303(0.32)  LDD0814  [20]
 LDCM0217  AC101 HEK-293T C303(0.49)  LDD0815  [20]
 LDCM0218  AC102 HEK-293T C303(0.37)  LDD0816  [20]
 LDCM0219  AC103 HEK-293T C303(0.29)  LDD0817  [20]
 LDCM0220  AC104 HEK-293T C303(0.43)  LDD0818  [20]
 LDCM0221  AC105 HEK-293T C303(1.22)  LDD0819  [20]
 LDCM0222  AC106 HEK-293T C303(0.86)  LDD0820  [20]
 LDCM0223  AC107 HEK-293T C303(0.30)  LDD0821  [20]
 LDCM0224  AC108 HEK-293T C303(1.27)  LDD0822  [20]
 LDCM0225  AC109 HEK-293T C303(0.61)  LDD0823  [20]
 LDCM0226  AC11 HEK-293T C127(0.99)  LDD0824  [20]
 LDCM0227  AC110 HEK-293T C303(0.34)  LDD0825  [20]
 LDCM0228  AC111 HEK-293T C303(0.60)  LDD0826  [20]
 LDCM0229  AC112 HEK-293T C303(0.30)  LDD0827  [20]
 LDCM0230  AC113 PaTu 8988t C127(1.21); C129(1.21); C303(1.03)  LDD1109  [20]
 LDCM0231  AC114 PaTu 8988t C127(1.24); C129(1.24); C303(1.09)  LDD1110  [20]
 LDCM0232  AC115 PaTu 8988t C127(1.06); C129(1.06); C303(0.96)  LDD1111  [20]
 LDCM0233  AC116 PaTu 8988t C127(0.85); C129(0.85); C303(1.31)  LDD1112  [20]
 LDCM0234  AC117 PaTu 8988t C127(0.69); C129(0.69); C303(0.88)  LDD1113  [20]
 LDCM0235  AC118 PaTu 8988t C127(1.77); C129(1.77); C303(0.80)  LDD1114  [20]
 LDCM0236  AC119 PaTu 8988t C127(2.23); C129(2.23); C303(1.00)  LDD1115  [20]
 LDCM0237  AC12 HEK-293T C127(1.08)  LDD0835  [20]
 LDCM0238  AC120 PaTu 8988t C127(1.54); C129(1.54); C303(1.35)  LDD1117  [20]
 LDCM0239  AC121 PaTu 8988t C127(1.70); C129(1.70); C303(1.40)  LDD1118  [20]
 LDCM0240  AC122 PaTu 8988t C127(1.62); C129(1.62); C303(1.23)  LDD1119  [20]
 LDCM0241  AC123 PaTu 8988t C127(0.85); C129(0.85); C303(0.90)  LDD1120  [20]
 LDCM0242  AC124 PaTu 8988t C127(1.80); C129(1.80); C303(1.33)  LDD1121  [20]
 LDCM0243  AC125 PaTu 8988t C127(2.10); C129(2.10); C303(0.94)  LDD1122  [20]
 LDCM0244  AC126 PaTu 8988t C127(1.51); C129(1.51); C303(0.98)  LDD1123  [20]
 LDCM0245  AC127 PaTu 8988t C127(1.25); C129(1.25); C303(1.18)  LDD1124  [20]
 LDCM0246  AC128 HEK-293T C127(0.89)  LDD0844  [20]
 LDCM0247  AC129 HEK-293T C127(0.78)  LDD0845  [20]
 LDCM0249  AC130 HEK-293T C127(0.80)  LDD0847  [20]
 LDCM0250  AC131 HEK-293T C127(0.86)  LDD0848  [20]
 LDCM0251  AC132 HEK-293T C127(0.79)  LDD0849  [20]
 LDCM0252  AC133 HEK-293T C127(0.78)  LDD0850  [20]
 LDCM0253  AC134 HEK-293T C127(0.88)  LDD0851  [20]
 LDCM0254  AC135 HEK-293T C127(0.73)  LDD0852  [20]
 LDCM0255  AC136 HEK-293T C127(0.78)  LDD0853  [20]
 LDCM0256  AC137 HEK-293T C127(0.78)  LDD0854  [20]
 LDCM0257  AC138 HEK-293T C127(0.85)  LDD0855  [20]
 LDCM0258  AC139 HEK-293T C127(0.85)  LDD0856  [20]
 LDCM0259  AC14 HEK-293T C127(1.11)  LDD0857  [20]
 LDCM0260  AC140 HEK-293T C127(0.71)  LDD0858  [20]
 LDCM0261  AC141 HEK-293T C127(0.82)  LDD0859  [20]
 LDCM0262  AC142 HEK-293T C127(0.70)  LDD0860  [20]
 LDCM0263  AC143 HEK-293T C303(0.72)  LDD0861  [20]
 LDCM0264  AC144 HEK-293T C303(0.47)  LDD0862  [20]
 LDCM0265  AC145 HEK-293T C303(0.48)  LDD0863  [20]
 LDCM0266  AC146 HEK-293T C303(0.53)  LDD0864  [20]
 LDCM0267  AC147 HEK-293T C303(0.58)  LDD0865  [20]
 LDCM0268  AC148 HEK-293T C303(0.56)  LDD0866  [20]
 LDCM0269  AC149 HEK-293T C303(0.63)  LDD0867  [20]
 LDCM0270  AC15 HEK-293T C127(1.21)  LDD0868  [20]
 LDCM0271  AC150 HEK-293T C303(0.42)  LDD0869  [20]
 LDCM0272  AC151 HEK-293T C303(0.45)  LDD0870  [20]
 LDCM0273  AC152 HEK-293T C303(0.71)  LDD0871  [20]
 LDCM0274  AC153 HEK-293T C303(0.60)  LDD0872  [20]
 LDCM0621  AC154 HEK-293T C303(0.96)  LDD2162  [20]
 LDCM0622  AC155 HEK-293T C303(0.64)  LDD2163  [20]
 LDCM0623  AC156 HEK-293T C303(0.56)  LDD2164  [20]
 LDCM0624  AC157 HEK-293T C303(0.83)  LDD2165  [20]
 LDCM0276  AC17 HEK-293T C127(1.04)  LDD0874  [20]
 LDCM0277  AC18 HEK-293T C127(1.08)  LDD0875  [20]
 LDCM0278  AC19 HEK-293T C127(1.08)  LDD0876  [20]
 LDCM0279  AC2 HEK-293T C127(1.31)  LDD0877  [20]
 LDCM0280  AC20 HEK-293T C127(0.99)  LDD0878  [20]
 LDCM0281  AC21 HEK-293T C127(1.28)  LDD0879  [20]
 LDCM0282  AC22 HEK-293T C127(1.26)  LDD0880  [20]
 LDCM0283  AC23 HEK-293T C127(1.05)  LDD0881  [20]
 LDCM0284  AC24 HEK-293T C127(1.26)  LDD0882  [20]
 LDCM0285  AC25 PaTu 8988t C127(0.72); C129(0.72); C303(0.84)  LDD1164  [20]
 LDCM0286  AC26 PaTu 8988t C127(1.00); C129(1.00); C303(1.19)  LDD1165  [20]
 LDCM0287  AC27 PaTu 8988t C127(1.28); C129(1.28); C303(0.97)  LDD1166  [20]
 LDCM0288  AC28 PaTu 8988t C127(1.08); C129(1.08); C303(1.08)  LDD1167  [20]
 LDCM0289  AC29 PaTu 8988t C127(1.06); C129(1.06); C303(0.97)  LDD1168  [20]
 LDCM0290  AC3 HEK-293T C127(1.10)  LDD0888  [20]
 LDCM0291  AC30 PaTu 8988t C127(0.86); C129(0.86); C303(0.83)  LDD1170  [20]
 LDCM0292  AC31 PaTu 8988t C127(0.67); C129(0.67); C303(0.76)  LDD1171  [20]
 LDCM0293  AC32 PaTu 8988t C127(0.88); C129(0.88); C303(0.93)  LDD1172  [20]
 LDCM0294  AC33 PaTu 8988t C127(1.04); C129(1.04); C303(1.22)  LDD1173  [20]
 LDCM0295  AC34 PaTu 8988t C127(0.77); C129(0.77); C303(1.08)  LDD1174  [20]
 LDCM0296  AC35 PaTu 8988t C127(1.36); C129(1.04); C303(0.93)  LDD1175  [20]
 LDCM0297  AC36 PaTu 8988t C127(1.09); C129(0.97); C303(1.15)  LDD1176  [20]
 LDCM0298  AC37 PaTu 8988t C127(1.27); C129(1.07); C303(1.07)  LDD1177  [20]
 LDCM0299  AC38 PaTu 8988t C127(1.26); C129(1.14); C303(1.21)  LDD1178  [20]
 LDCM0300  AC39 PaTu 8988t C127(1.23); C129(1.19); C303(1.27)  LDD1179  [20]
 LDCM0301  AC4 HEK-293T C127(1.29)  LDD0899  [20]
 LDCM0302  AC40 PaTu 8988t C127(1.59); C129(1.39); C303(1.36)  LDD1181  [20]
 LDCM0303  AC41 PaTu 8988t C127(1.17); C129(1.04); C303(0.87)  LDD1182  [20]
 LDCM0304  AC42 PaTu 8988t C127(1.45); C129(1.29); C303(1.03)  LDD1183  [20]
 LDCM0305  AC43 PaTu 8988t C127(1.43); C129(1.35); C303(1.13)  LDD1184  [20]
 LDCM0306  AC44 PaTu 8988t C127(1.98); C129(1.71); C303(1.51)  LDD1185  [20]
 LDCM0307  AC45 PaTu 8988t C127(1.48); C129(1.38); C303(1.20)  LDD1186  [20]
 LDCM0308  AC46 PaTu 8988t C127(1.51); C129(1.53); C303(1.46)  LDD1187  [20]
 LDCM0309  AC47 PaTu 8988t C127(1.45); C129(1.49); C303(1.53)  LDD1188  [20]
 LDCM0310  AC48 PaTu 8988t C127(1.31); C129(1.31); C303(1.30)  LDD1189  [20]
 LDCM0311  AC49 PaTu 8988t C127(1.74); C129(1.71); C303(2.07)  LDD1190  [20]
 LDCM0312  AC5 HEK-293T C127(1.30)  LDD0910  [20]
 LDCM0313  AC50 PaTu 8988t C127(1.75); C129(1.75); C303(1.80)  LDD1192  [20]
 LDCM0314  AC51 PaTu 8988t C127(0.81); C129(0.81); C303(0.54)  LDD1193  [20]
 LDCM0315  AC52 PaTu 8988t C127(1.04); C129(1.07); C303(1.30)  LDD1194  [20]
 LDCM0316  AC53 PaTu 8988t C127(1.42); C129(1.43); C303(1.64)  LDD1195  [20]
 LDCM0317  AC54 PaTu 8988t C127(1.76); C129(1.73); C303(1.88)  LDD1196  [20]
 LDCM0318  AC55 PaTu 8988t C127(1.37); C129(1.36); C303(1.29)  LDD1197  [20]
 LDCM0319  AC56 PaTu 8988t C127(1.74); C129(1.79); C303(1.36)  LDD1198  [20]
 LDCM0320  AC57 HEK-293T C127(1.11)  LDD0918  [20]
 LDCM0321  AC58 HEK-293T C127(1.12)  LDD0919  [20]
 LDCM0322  AC59 HEK-293T C127(0.98)  LDD0920  [20]
 LDCM0323  AC6 HEK-293T C127(1.06)  LDD0921  [20]
 LDCM0324  AC60 HEK-293T C127(1.07)  LDD0922  [20]
 LDCM0325  AC61 HEK-293T C127(1.11)  LDD0923  [20]
 LDCM0326  AC62 HEK-293T C127(1.11)  LDD0924  [20]
 LDCM0327  AC63 HEK-293T C127(1.06)  LDD0925  [20]
 LDCM0328  AC64 HEK-293T C127(1.12)  LDD0926  [20]
 LDCM0329  AC65 HEK-293T C127(1.07)  LDD0927  [20]
 LDCM0330  AC66 HEK-293T C127(0.99)  LDD0928  [20]
 LDCM0331  AC67 HEK-293T C127(1.10)  LDD0929  [20]
 LDCM0332  AC68 HEK-293T C127(1.09); C303(1.03)  LDD0930  [20]
 LDCM0333  AC69 HEK-293T C127(1.05); C303(0.91)  LDD0931  [20]
 LDCM0334  AC7 HEK-293T C127(1.01)  LDD0932  [20]
 LDCM0335  AC70 HEK-293T C127(1.17); C303(1.55)  LDD0933  [20]
 LDCM0336  AC71 HEK-293T C127(1.26); C303(0.91)  LDD0934  [20]
 LDCM0337  AC72 HEK-293T C127(1.11); C303(0.75)  LDD0935  [20]
 LDCM0338  AC73 HEK-293T C127(1.13); C303(0.82)  LDD0936  [20]
 LDCM0339  AC74 HEK-293T C127(1.22); C303(0.81)  LDD0937  [20]
 LDCM0340  AC75 HEK-293T C127(1.52); C303(1.29)  LDD0938  [20]
 LDCM0341  AC76 HEK-293T C127(1.29); C303(0.85)  LDD0939  [20]
 LDCM0342  AC77 HEK-293T C127(1.37); C303(0.73)  LDD0940  [20]
 LDCM0343  AC78 HEK-293T C127(1.22); C303(0.94)  LDD0941  [20]
 LDCM0344  AC79 HEK-293T C127(1.30); C303(1.74)  LDD0942  [20]
 LDCM0345  AC8 HEK-293T C127(1.12)  LDD0943  [20]
 LDCM0346  AC80 HEK-293T C127(1.28); C303(0.88)  LDD0944  [20]
 LDCM0347  AC81 HEK-293T C127(1.31); C303(0.96)  LDD0945  [20]
 LDCM0348  AC82 HEK-293T C127(1.43); C303(0.97)  LDD0946  [20]
 LDCM0349  AC83 HEK-293T C127(1.23); C303(0.60)  LDD0947  [20]
 LDCM0350  AC84 HEK-293T C127(0.90); C303(0.27)  LDD0948  [20]
 LDCM0351  AC85 HEK-293T C127(1.57); C303(0.49)  LDD0949  [20]
 LDCM0352  AC86 HEK-293T C127(0.87); C303(0.46)  LDD0950  [20]
 LDCM0353  AC87 HEK-293T C127(0.88); C303(0.52)  LDD0951  [20]
 LDCM0354  AC88 HEK-293T C127(1.06); C303(0.32)  LDD0952  [20]
 LDCM0355  AC89 HEK-293T C127(0.78); C303(0.15)  LDD0953  [20]
 LDCM0357  AC90 HEK-293T C127(1.06); C303(0.21)  LDD0955  [20]
 LDCM0358  AC91 HEK-293T C127(0.98); C303(0.25)  LDD0956  [20]
 LDCM0359  AC92 HEK-293T C127(1.01); C303(0.89)  LDD0957  [20]
 LDCM0360  AC93 HEK-293T C127(1.08); C303(0.74)  LDD0958  [20]
 LDCM0361  AC94 HEK-293T C127(1.19); C303(0.14)  LDD0959  [20]
 LDCM0362  AC95 HEK-293T C127(0.97); C303(0.22)  LDD0960  [20]
 LDCM0363  AC96 HEK-293T C127(1.00); C303(0.43)  LDD0961  [20]
 LDCM0364  AC97 HEK-293T C127(1.18); C303(0.12)  LDD0962  [20]
 LDCM0365  AC98 HEK-293T C303(0.81)  LDD0963  [20]
 LDCM0366  AC99 HEK-293T C303(1.00)  LDD0964  [20]
 LDCM0248  AKOS034007472 HEK-293T C127(1.06)  LDD0846  [20]
 LDCM0356  AKOS034007680 HEK-293T C127(1.03)  LDD0954  [20]
 LDCM0275  AKOS034007705 HEK-293T C127(0.99)  LDD0873  [20]
 LDCM0156  Aniline NCI-H1299 11.70  LDD0403  [1]
 LDCM0020  ARS-1620 HCC44 C127(1.11); C129(1.11)  LDD2171  [20]
 LDCM0083  Avasimibe A-549 2.39  LDD0143  [44]
 LDCM0151  AZ-11 HeLa 10.00  LDD2154  [4]
 LDCM0498  BS-3668 MDA-MB-231 C354(0.62)  LDD2091  [49]
 LDCM0630  CCW28-3 231MFP C201(2.12); C211(1.49); C303(1.42); C239(1.41)  LDD2214  [50]
 LDCM0108  Chloroacetamide HeLa H28(0.00); H37(0.00)  LDD0222  [36]
 LDCM0367  CL1 HEK-293T C127(0.69)  LDD0965  [20]
 LDCM0368  CL10 HEK-293T C127(0.86)  LDD0966  [20]
 LDCM0369  CL100 HEK-293T C127(1.38)  LDD0967  [20]
 LDCM0370  CL101 HEK-293T C127(1.09)  LDD0968  [20]
 LDCM0371  CL102 HEK-293T C127(1.12)  LDD0969  [20]
 LDCM0372  CL103 HEK-293T C127(0.94)  LDD0970  [20]
 LDCM0373  CL104 HEK-293T C127(1.17)  LDD0971  [20]
 LDCM0374  CL105 HEK-293T C127(1.01)  LDD0972  [20]
 LDCM0375  CL106 HEK-293T C127(1.13)  LDD0973  [20]
 LDCM0376  CL107 HEK-293T C127(1.32)  LDD0974  [20]
 LDCM0377  CL108 HEK-293T C127(1.15)  LDD0975  [20]
 LDCM0378  CL109 HEK-293T C127(1.02)  LDD0976  [20]
 LDCM0379  CL11 HEK-293T C127(0.75)  LDD0977  [20]
 LDCM0380  CL110 HEK-293T C127(1.02)  LDD0978  [20]
 LDCM0381  CL111 HEK-293T C127(1.00)  LDD0979  [20]
 LDCM0382  CL112 PaTu 8988t C127(0.92); C129(0.92); C303(0.76)  LDD1261  [20]
 LDCM0383  CL113 PaTu 8988t C127(0.74); C129(0.74); C303(0.78)  LDD1262  [20]
 LDCM0384  CL114 PaTu 8988t C127(0.88); C129(0.88); C303(0.79)  LDD1263  [20]
 LDCM0385  CL115 PaTu 8988t C127(1.11); C129(1.11); C303(0.85)  LDD1264  [20]
 LDCM0386  CL116 PaTu 8988t C127(0.97); C129(0.97); C303(0.97)  LDD1265  [20]
 LDCM0387  CL117 PaTu 8988t C127(0.97); C129(0.97); C303(0.98)  LDD1266  [20]
 LDCM0388  CL118 PaTu 8988t C127(1.44); C129(1.21); C303(1.15)  LDD1267  [20]
 LDCM0389  CL119 PaTu 8988t C127(1.31); C129(1.12); C303(1.02)  LDD1268  [20]
 LDCM0390  CL12 HEK-293T C127(0.91)  LDD0988  [20]
 LDCM0391  CL120 PaTu 8988t C127(1.38); C129(1.31); C303(1.11)  LDD1270  [20]
 LDCM0392  CL121 PaTu 8988t C127(1.10); C129(1.07); C303(1.09)  LDD1271  [20]
 LDCM0393  CL122 PaTu 8988t C127(1.58); C129(1.71); C303(1.47)  LDD1272  [20]
 LDCM0394  CL123 PaTu 8988t C127(1.43); C129(1.44); C303(1.60)  LDD1273  [20]
 LDCM0395  CL124 PaTu 8988t C127(1.86); C129(1.89); C303(1.70)  LDD1274  [20]
 LDCM0396  CL125 HEK-293T C127(1.14)  LDD0994  [20]
 LDCM0397  CL126 HEK-293T C127(1.09)  LDD0995  [20]
 LDCM0398  CL127 HEK-293T C127(1.26)  LDD0996  [20]
 LDCM0399  CL128 HEK-293T C127(1.01)  LDD0997  [20]
 LDCM0400  CL13 HEK-293T C127(1.08)  LDD0998  [20]
 LDCM0401  CL14 HEK-293T C127(0.82)  LDD0999  [20]
 LDCM0402  CL15 HEK-293T C127(0.76)  LDD1000  [20]
 LDCM0403  CL16 PaTu 8988t C127(0.96); C129(1.07); C303(1.35)  LDD1282  [20]
 LDCM0404  CL17 PaTu 8988t C127(1.19); C129(1.19); C303(1.52)  LDD1283  [20]
 LDCM0405  CL18 PaTu 8988t C127(1.28); C129(1.43); C303(1.02)  LDD1284  [20]
 LDCM0406  CL19 PaTu 8988t C127(1.51); C129(1.66); C303(1.35)  LDD1285  [20]
 LDCM0407  CL2 HEK-293T C127(0.75)  LDD1005  [20]
 LDCM0408  CL20 PaTu 8988t C127(1.40); C129(1.52); C303(1.46)  LDD1287  [20]
 LDCM0409  CL21 PaTu 8988t C127(1.89); C129(1.96); C303(1.28)  LDD1288  [20]
 LDCM0410  CL22 PaTu 8988t C127(1.41); C129(1.51); C303(1.40)  LDD1289  [20]
 LDCM0411  CL23 PaTu 8988t C127(1.07); C129(1.22); C303(1.61)  LDD1290  [20]
 LDCM0412  CL24 PaTu 8988t C127(1.22); C129(1.34); C303(1.59)  LDD1291  [20]
 LDCM0413  CL25 PaTu 8988t C127(1.43); C129(1.47); C303(1.40)  LDD1292  [20]
 LDCM0414  CL26 PaTu 8988t C127(1.26); C129(1.41); C303(1.24)  LDD1293  [20]
 LDCM0415  CL27 PaTu 8988t C127(1.71); C129(1.73); C303(1.59)  LDD1294  [20]
 LDCM0416  CL28 PaTu 8988t C127(0.96); C129(1.08); C303(1.55)  LDD1295  [20]
 LDCM0417  CL29 PaTu 8988t C127(1.52); C129(1.75); C303(1.61)  LDD1296  [20]
 LDCM0418  CL3 HEK-293T C127(0.89)  LDD1016  [20]
 LDCM0419  CL30 PaTu 8988t C127(1.47); C129(1.75); C303(1.62)  LDD1298  [20]
 LDCM0420  CL31 HEK-293T C303(0.96)  LDD1018  [20]
 LDCM0421  CL32 HEK-293T C303(1.27)  LDD1019  [20]
 LDCM0422  CL33 HEK-293T C303(1.45)  LDD1020  [20]
 LDCM0423  CL34 HEK-293T C303(1.26)  LDD1021  [20]
 LDCM0424  CL35 HEK-293T C303(1.91)  LDD1022  [20]
 LDCM0425  CL36 HEK-293T C303(1.69)  LDD1023  [20]
 LDCM0426  CL37 HEK-293T C303(1.12)  LDD1024  [20]
 LDCM0428  CL39 HEK-293T C303(0.41)  LDD1026  [20]
 LDCM0429  CL4 HEK-293T C127(0.77)  LDD1027  [20]
 LDCM0430  CL40 HEK-293T C303(1.00)  LDD1028  [20]
 LDCM0431  CL41 HEK-293T C303(0.43)  LDD1029  [20]
 LDCM0432  CL42 HEK-293T C303(0.46)  LDD1030  [20]
 LDCM0433  CL43 HEK-293T C303(0.59)  LDD1031  [20]
 LDCM0434  CL44 HEK-293T C303(1.17)  LDD1032  [20]
 LDCM0435  CL45 HEK-293T C303(0.53)  LDD1033  [20]
 LDCM0436  CL46 PaTu 8988t C127(1.30); C129(1.35); C303(1.07)  LDD1315  [20]
 LDCM0437  CL47 PaTu 8988t C127(0.71); C129(0.74); C303(0.76)  LDD1316  [20]
 LDCM0438  CL48 PaTu 8988t C127(1.00); C129(1.05); C303(1.09)  LDD1317  [20]
 LDCM0439  CL49 PaTu 8988t C127(1.42); C129(1.41); C303(1.34)  LDD1318  [20]
 LDCM0440  CL5 HEK-293T C127(1.03)  LDD1038  [20]
 LDCM0441  CL50 PaTu 8988t C127(0.92); C129(1.00); C303(1.06)  LDD1320  [20]
 LDCM0442  CL51 PaTu 8988t C127(1.21); C129(1.25); C303(1.45)  LDD1321  [20]
 LDCM0443  CL52 PaTu 8988t C127(1.61); C129(1.65); C303(1.38)  LDD1322  [20]
 LDCM0444  CL53 PaTu 8988t C127(0.82); C129(0.88); C303(1.19)  LDD1323  [20]
 LDCM0445  CL54 PaTu 8988t C127(1.36); C129(1.39); C303(1.15)  LDD1324  [20]
 LDCM0446  CL55 PaTu 8988t C127(1.45); C129(1.51); C303(1.25)  LDD1325  [20]
 LDCM0447  CL56 PaTu 8988t C127(1.15); C129(1.37); C303(0.68)  LDD1326  [20]
 LDCM0448  CL57 PaTu 8988t C127(1.83); C129(1.85); C303(1.63)  LDD1327  [20]
 LDCM0449  CL58 PaTu 8988t C127(1.79); C129(1.85); C303(1.35)  LDD1328  [20]
 LDCM0450  CL59 PaTu 8988t C127(2.27); C129(2.37); C303(1.83)  LDD1329  [20]
 LDCM0451  CL6 HEK-293T C127(0.85)  LDD1049  [20]
 LDCM0452  CL60 PaTu 8988t C127(1.16); C129(1.16); C303(1.47)  LDD1331  [20]
 LDCM0453  CL61 PaTu 8988t C127(1.04); C129(1.09); C303(1.04)  LDD1332  [20]
 LDCM0454  CL62 PaTu 8988t C127(1.21); C129(1.18); C303(1.08)  LDD1333  [20]
 LDCM0455  CL63 PaTu 8988t C127(0.98); C129(1.02); C303(0.97)  LDD1334  [20]
 LDCM0456  CL64 PaTu 8988t C127(0.96); C129(1.00); C303(0.99)  LDD1335  [20]
 LDCM0457  CL65 PaTu 8988t C127(1.11); C129(1.20); C303(1.02)  LDD1336  [20]
 LDCM0458  CL66 PaTu 8988t C127(1.10); C129(1.11); C303(0.78)  LDD1337  [20]
 LDCM0459  CL67 PaTu 8988t C127(1.14); C129(1.16); C303(1.04)  LDD1338  [20]
 LDCM0460  CL68 PaTu 8988t C127(1.12); C129(1.14); C303(1.72)  LDD1339  [20]
 LDCM0461  CL69 PaTu 8988t C127(1.41); C129(1.57); C303(1.24)  LDD1340  [20]
 LDCM0462  CL7 HEK-293T C127(0.79)  LDD1060  [20]
 LDCM0463  CL70 PaTu 8988t C127(0.95); C129(0.94); C303(1.41)  LDD1342  [20]
 LDCM0464  CL71 PaTu 8988t C127(1.16); C129(1.25); C303(0.92)  LDD1343  [20]
 LDCM0465  CL72 PaTu 8988t C127(0.85); C129(0.93); C303(0.79)  LDD1344  [20]
 LDCM0466  CL73 PaTu 8988t C127(1.49); C129(1.57); C303(1.27)  LDD1345  [20]
 LDCM0467  CL74 PaTu 8988t C127(1.13); C129(1.24); C303(0.97)  LDD1346  [20]
 LDCM0469  CL76 PaTu 8988t C127(1.07); C129(1.06); C303(1.19)  LDD1348  [20]
 LDCM0470  CL77 PaTu 8988t C127(1.34); C129(1.46); C303(1.22)  LDD1349  [20]
 LDCM0471  CL78 PaTu 8988t C127(1.36); C129(1.45); C303(1.65)  LDD1350  [20]
 LDCM0472  CL79 PaTu 8988t C127(1.18); C129(0.86); C303(1.66)  LDD1351  [20]
 LDCM0473  CL8 HEK-293T C127(0.92)  LDD1071  [20]
 LDCM0474  CL80 PaTu 8988t C127(1.54); C129(1.47); C303(1.65)  LDD1353  [20]
 LDCM0475  CL81 PaTu 8988t C127(1.78); C129(1.92); C303(1.77)  LDD1354  [20]
 LDCM0476  CL82 PaTu 8988t C127(1.24); C129(1.12); C303(1.51)  LDD1355  [20]
 LDCM0477  CL83 PaTu 8988t C127(1.66); C129(1.69); C303(1.83)  LDD1356  [20]
 LDCM0478  CL84 PaTu 8988t C127(2.10); C129(2.00); C303(1.74)  LDD1357  [20]
 LDCM0479  CL85 PaTu 8988t C127(1.59); C129(1.46); C303(1.47)  LDD1358  [20]
 LDCM0480  CL86 PaTu 8988t C127(1.87); C129(2.03); C303(1.38)  LDD1359  [20]
 LDCM0481  CL87 PaTu 8988t C127(2.05); C129(2.10); C303(1.76)  LDD1360  [20]
 LDCM0482  CL88 PaTu 8988t C127(1.74); C129(1.60); C303(1.73)  LDD1361  [20]
 LDCM0483  CL89 PaTu 8988t C127(1.80); C129(1.96); C303(1.52)  LDD1362  [20]
 LDCM0484  CL9 HEK-293T C127(1.03)  LDD1082  [20]
 LDCM0485  CL90 PaTu 8988t C127(1.85); C129(1.96); C303(1.53)  LDD1364  [20]
 LDCM0486  CL91 HEK-293T C127(1.21)  LDD1084  [20]
 LDCM0487  CL92 HEK-293T C127(1.41)  LDD1085  [20]
 LDCM0488  CL93 HEK-293T C127(1.13)  LDD1086  [20]
 LDCM0489  CL94 HEK-293T C127(1.24)  LDD1087  [20]
 LDCM0490  CL95 HEK-293T C127(1.38)  LDD1088  [20]
 LDCM0491  CL96 HEK-293T C127(1.33)  LDD1089  [20]
 LDCM0492  CL97 HEK-293T C127(1.27)  LDD1090  [20]
 LDCM0493  CL98 HEK-293T C127(1.19)  LDD1091  [20]
 LDCM0494  CL99 HEK-293T C127(1.49)  LDD1092  [20]
 LDCM0189  Compound 16 HEK-293T 10.44  LDD0492  [42]
 LDCM0182  Compound 18 HEK-293T 7.17  LDD0501  [42]
 LDCM0191  Compound 21 HEK-293T 7.46  LDD0493  [42]
 LDCM0190  Compound 34 HEK-293T 12.01  LDD0497  [42]
 LDCM0192  Compound 35 HEK-293T 6.53  LDD0491  [42]
 LDCM0193  Compound 36 HEK-293T 5.15  LDD0494  [42]
 LDCM0194  Compound 37 HEK-293T 9.17  LDD0498  [42]
 LDCM0195  Compound 38 HEK-293T 6.90  LDD0499  [42]
 LDCM0196  Compound 39 HEK-293T 6.46  LDD0496  [42]
 LDCM0197  Compound 40 HEK-293T 6.13  LDD0495  [42]
 LDCM0181  Compound 41 HEK-293T 8.24  LDD0502  [42]
 LDCM0183  Compound 42 HEK-293T 4.63  LDD0500  [42]
 LDCM0495  E2913 HEK-293T C303(0.93); C354(1.01); C12(0.86)  LDD1698  [51]
 LDCM0175  Ethacrynic acid HeLa N.A.  LDD0440  [16]
 LDCM0572  Fragment10 MDA-MB-231 C239(1.71); C354(1.91)  LDD1389  [52]
 LDCM0573  Fragment11 MDA-MB-231 C239(1.23); C354(2.21)  LDD1391  [52]
 LDCM0574  Fragment12 MDA-MB-231 C239(1.84)  LDD1393  [52]
 LDCM0575  Fragment13 MDA-MB-231 C239(1.13); C354(1.03)  LDD1395  [52]
 LDCM0576  Fragment14 MDA-MB-231 C239(1.34); C354(1.71)  LDD1397  [52]
 LDCM0577  Fragment15 MDA-MB-231 C239(2.84)  LDD1399  [52]
 LDCM0579  Fragment20 MDA-MB-231 C239(2.50); C354(0.95)  LDD1402  [52]
 LDCM0580  Fragment21 MDA-MB-231 C239(1.16); C354(1.13)  LDD1404  [52]
 LDCM0581  Fragment22 MDA-MB-231 C239(1.13); C354(1.30)  LDD1406  [52]
 LDCM0582  Fragment23 MDA-MB-231 C239(2.82); C354(2.89)  LDD1408  [52]
 LDCM0583  Fragment24 Ramos C239(1.35); C354(1.29)  LDD1410  [52]
 LDCM0584  Fragment25 MDA-MB-231 C239(1.00); C354(0.75)  LDD1411  [52]
 LDCM0585  Fragment26 Ramos C239(0.90); C354(0.92)  LDD1412  [52]
 LDCM0578  Fragment27 MDA-MB-231 C239(0.94); C354(0.91)  LDD1401  [52]
 LDCM0586  Fragment28 Ramos C239(1.22); C354(1.06)  LDD1416  [52]
 LDCM0587  Fragment29 MDA-MB-231 C239(1.02); C354(1.28)  LDD1417  [52]
 LDCM0588  Fragment30 MDA-MB-231 C239(1.16); C354(0.90)  LDD1419  [52]
 LDCM0589  Fragment31 MDA-MB-231 C239(2.19); C354(2.37)  LDD1421  [52]
 LDCM0590  Fragment32 MDA-MB-231 C239(2.13); C354(2.62)  LDD1423  [52]
 LDCM0468  Fragment33 PaTu 8988t C127(1.19); C129(1.26); C303(0.88)  LDD1347  [20]
 LDCM0592  Fragment34 MDA-MB-231 C239(0.98); C354(0.88)  LDD1427  [52]
 LDCM0593  Fragment35 MDA-MB-231 C239(0.86); C354(0.84)  LDD1429  [52]
 LDCM0594  Fragment36 MDA-MB-231 C239(1.27); C354(1.78)  LDD1431  [52]
 LDCM0595  Fragment37 Ramos C239(0.94); C354(0.90)  LDD1432  [52]
 LDCM0596  Fragment38 MDA-MB-231 C239(1.15); C354(1.07)  LDD1433  [52]
 LDCM0597  Fragment39 MDA-MB-231 C239(1.47); C354(1.49)  LDD1435  [52]
 LDCM0566  Fragment4 MDA-MB-231 C239(1.69); C354(2.14)  LDD1378  [52]
 LDCM0598  Fragment40 MDA-MB-231 C239(0.94); C354(0.83)  LDD1436  [52]
 LDCM0599  Fragment41 Ramos C239(1.99); C354(0.78)  LDD1439  [52]
 LDCM0600  Fragment42 Ramos C239(0.98); C354(1.00)  LDD1440  [52]
 LDCM0601  Fragment43 MDA-MB-231 C239(1.49); C354(2.11)  LDD1441  [52]
 LDCM0602  Fragment44 MDA-MB-231 C239(0.84); C354(0.80)  LDD1443  [52]
 LDCM0603  Fragment45 MDA-MB-231 C239(2.73); C354(3.26)  LDD1444  [52]
 LDCM0604  Fragment46 MDA-MB-231 C239(1.09); C354(0.96)  LDD1445  [52]
 LDCM0605  Fragment47 MDA-MB-231 C239(1.24); C354(1.27)  LDD1446  [52]
 LDCM0607  Fragment49 MDA-MB-231 C239(3.53)  LDD1448  [52]
 LDCM0608  Fragment50 MDA-MB-231 C239(2.59); C354(1.78)  LDD1449  [52]
 LDCM0427  Fragment51 HEK-293T C303(1.40)  LDD1025  [20]
 LDCM0610  Fragment52 MDA-MB-231 C239(1.11); C354(1.21)  LDD1452  [52]
 LDCM0611  Fragment53 MDA-MB-231 C239(1.09); C354(0.96)  LDD1454  [52]
 LDCM0613  Fragment55 MDA-MB-231 C239(1.10); C354(1.00)  LDD1457  [52]
 LDCM0614  Fragment56 MDA-MB-231 C239(1.52); C354(0.98)  LDD1458  [52]
 LDCM0569  Fragment7 MDA-MB-231 C239(1.45); C354(2.20)  LDD1383  [52]
 LDCM0570  Fragment8 MDA-MB-231 C239(1.42); C354(1.84)  LDD1385  [52]
 LDCM0571  Fragment9 MDA-MB-231 C239(1.74); C354(1.75)  LDD1387  [52]
 LDCM0116  HHS-0101 DM93 Y222(0.69); Y50(0.75); Y310(0.76); Y106(0.78)  LDD0264  [18]
 LDCM0117  HHS-0201 DM93 Y222(0.59); Y36(0.60); Y50(0.65); Y51(0.66)  LDD0265  [18]
 LDCM0118  HHS-0301 DM93 Y222(0.62); Y36(0.66); Y106(0.66); Y50(0.70)  LDD0266  [18]
 LDCM0119  HHS-0401 DM93 Y51(0.52); Y50(0.59); Y36(0.60); Y222(0.63)  LDD0267  [18]
 LDCM0120  HHS-0701 DM93 Y36(0.60); Y106(0.62); Y222(0.63); Y50(0.66)  LDD0268  [18]
 LDCM0015  HNE MDA-MB-231 C239(0.98)  LDD0346  [53]
 LDCM0107  IAA HeLa H28(0.00); H37(0.00)  LDD0221  [36]
 LDCM0123  JWB131 DM93 Y106(0.87); Y159(0.84); Y183(0.83); Y200(1.00)  LDD0285  [17]
 LDCM0124  JWB142 DM93 Y106(0.58); Y159(0.91); Y183(0.66); Y200(0.53)  LDD0286  [17]
 LDCM0125  JWB146 DM93 Y106(1.35); Y159(0.95); Y183(1.22); Y200(0.83)  LDD0287  [17]
 LDCM0126  JWB150 DM93 Y106(3.89); Y159(3.15); Y183(1.44); Y200(1.58)  LDD0288  [17]
 LDCM0127  JWB152 DM93 Y106(2.42); Y159(1.55); Y183(1.19); Y200(1.54)  LDD0289  [17]
 LDCM0128  JWB198 DM93 Y106(0.86); Y159(0.84); Y183(0.88); Y200(0.71)  LDD0290  [17]
 LDCM0129  JWB202 DM93 Y106(0.38); Y159(0.56); Y183(0.69); Y200(0.62)  LDD0291  [17]
 LDCM0130  JWB211 DM93 Y106(0.94); Y159(0.91); Y183(0.91); Y200(0.94)  LDD0292  [17]
 LDCM0179  JZ128 PC-3 C201(0.00); C354(0.00); C12(0.00)  LDD0462  [13]
 LDCM0022  KB02 HCT 116 C127(2.14); C129(2.14)  LDD0080  [20]
 LDCM0023  KB03 HCT 116 C127(4.13); C129(4.13)  LDD0081  [20]
 LDCM0024  KB05 HCT 116 C127(2.84); C129(2.84)  LDD0082  [20]
 LDCM0109  NEM HeLa H37(0.00); H28(0.00)  LDD0223  [36]
 LDCM0496  Nucleophilic fragment 11a MDA-MB-231 C354(0.71)  LDD2089  [49]
 LDCM0500  Nucleophilic fragment 13a MDA-MB-231 C354(0.98)  LDD2093  [49]
 LDCM0506  Nucleophilic fragment 16a MDA-MB-231 C354(1.02)  LDD2099  [49]
 LDCM0526  Nucleophilic fragment 26a MDA-MB-231 C354(2.07); C12(2.25)  LDD2119  [49]
 LDCM0540  Nucleophilic fragment 35 MDA-MB-231 C354(0.58)  LDD2133  [49]
 LDCM0556  Nucleophilic fragment 8a MDA-MB-231 C354(0.51); C12(0.32)  LDD2150  [49]
 LDCM0018  Orlistat Hep-G2 N.A.  LDD0077  [40]
 LDCM0159  P28 BxPC-3 2.25  LDD0409  [12]
 LDCM0014  Panhematin HEK-293T 5.79  LDD0062  [15]
 LDCM0021  THZ1 HeLa S3 C12(1.04)  LDD0460  [13]
 LDCM0110  W12 Hep-G2 C303(0.77); C354(1.14)  LDD0237  [37]
 LDCM0111  W14 Hep-G2 C354(0.53)  LDD0238  [37]

The Interaction Atlas With This Target

The Protein(s) Related To This Target

Enzyme
Click To Hide/Show 6 Protein(s) Interacting with This Target
Protein name Family Uniprot ID
Dihydrolipoyllysine-residue succinyltransferase component of 2-oxoglutarate dehydrogenase complex, mitochondrial (DLST) 2-oxoacid dehydrogenase family P36957
NADH dehydrogenase flavoprotein 2, mitochondrial (NDUFV2) Complex I 24 kDa subunit family P19404
Superoxide dismutase [Cu-Zn] (SOD1) Cu-Zn superoxide dismutase family P00441
Serine/threonine-protein kinase Nek7 (NEK7) NEK Ser/Thr protein kinase family Q8TDX7
Leucine-rich repeat serine/threonine-protein kinase 2 (LRRK2) TKL Ser/Thr protein kinase family Q5S007
Tubulin alpha-1A chain (TUBA1A) Tubulin family Q71U36
Transporter and channel
Click To Hide/Show 4 Protein(s) Interacting with This Target
Protein name Family Uniprot ID
Amyloid-beta precursor protein (APP) APP family P05067
Calreticulin (CALR) Calreticulin family P27797
Huntingtin (HTT) Huntingtin family P42858
Alpha-synuclein (SNCA) Synuclein family P37840
Transcription factor
Click To Hide/Show 1 Protein(s) Interacting with This Target
Protein name Family Uniprot ID
Transcription factor Jun (JUN) BZIP family P05412
Other
Click To Hide/Show 5 Protein(s) Interacting with This Target
Protein name Family Uniprot ID
RNA-binding protein FXR1 (FXR1) FMR1 family P51114
NEDD8 (NEDD8) Ubiquitin family Q15843
Sequestosome-1 (SQSTM1) . Q13501
TERF1-interacting nuclear factor 2 (TINF2) . Q9BSI4
Trefoil factor 2 (TFF2) . Q03403

The Drug(s) Related To This Target

Approved
Click To Hide/Show 10 Drug(s) Interacting with This Target
Drug Name Drug Type External ID
Colchicine Small molecular drug DB01394
Podofilox Small molecular drug DB01179
Tirbanibulin Small molecular drug DB06137
Vinblastine Small molecular drug DB00570
Vincristine Small molecular drug DB00541
Vinorelbine Small molecular drug DB00361
Artenimol . DB11638
Colchiceine . DB15534
Copper . DB09130
Vinflunine . DB11641
Investigative
Click To Hide/Show 7 Drug(s) Interacting with This Target
Drug Name Drug Type External ID
Epothilone D Small molecular drug DB01873
Milataxel Small molecular drug DB12334
Patupilone Small molecular drug DB03010
Ca4p . DB05284
Cyt997 . DB05147
Depatuxizumab Mafodotin . DB11731
Zen-012 . DB06042

References

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2 Comparison of Different Competitive Proteome Profiling Approaches in Target Identification of Covalent Inhibitors. Chembiochem. 2022 Dec 16;23(24):e202200389. doi: 10.1002/cbic.202200389. Epub 2022 Nov 22.
3 2-Ethynylbenzaldehyde-Based, Lysine-Targeting Irreversible Covalent Inhibitors for Protein Kinases and Nonkinases. J Am Chem Soc. 2023 Feb 12. doi: 10.1021/jacs.2c11595. Online ahead of print.
Mass spectrometry data entry: PXD037665
4 2H-Azirine-Based Reagents for Chemoselective Bioconjugation at Carboxyl Residues Inside Live Cells. J Am Chem Soc. 2020 Apr 1;142(13):6051-6059. doi: 10.1021/jacs.9b12116. Epub 2020 Mar 23.
5 Charting the Chemical Space of Acrylamide-Based Inhibitors of zDHHC20. ACS Med Chem Lett. 2022 Sep 26;13(10):1648-1654. doi: 10.1021/acsmedchemlett.2c00336. eCollection 2022 Oct 13.
6 Cyclopropenone, Cyclopropeniminium Ion, and Cyclopropenethione as Novel Electrophilic Warheads for Potential Target Discovery of Triple-Negative Breast Cancer. J Med Chem. 2023 Feb 23;66(4):2851-2864. doi: 10.1021/acs.jmedchem.2c01889. Epub 2023 Feb 10.
7 Chemoproteomic profiling of kinases in live cells using electrophilic sulfonyl triazole probes. Chem Sci. 2021 Jan 21;12(9):3295-3307. doi: 10.1039/d0sc06623k.
8 Ynamide Electrophile for the Profiling of Ligandable Carboxyl Residues in Live Cells and the Development of New Covalent Inhibitors. J Med Chem. 2022 Aug 11;65(15):10408-10418. doi: 10.1021/acs.jmedchem.2c00272. Epub 2022 Jul 26.
9 A Paal-Knorr agent for chemoproteomic profiling of targets of isoketals in cells. Chem Sci. 2021 Oct 15;12(43):14557-14563. doi: 10.1039/d1sc02230j. eCollection 2021 Nov 10.
Mass spectrometry data entry: PXD028270
10 A chemical proteomics approach for global mapping of functional lysines on cell surface of living cell. Nat Commun. 2024 Apr 8;15(1):2997. doi: 10.1038/s41467-024-47033-w.
Mass spectrometry data entry: PXD042888
11 An Azo Coupling-Based Chemoproteomic Approach to Systematically Profile the Tyrosine Reactivity in the Human Proteome. Anal Chem. 2021 Jul 27;93(29):10334-10342. doi: 10.1021/acs.analchem.1c01935. Epub 2021 Jul 12.
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13 A Chemoproteomic Strategy for Direct and Proteome-Wide Covalent Inhibitor Target-Site Identification. J Am Chem Soc. 2019 Jan 9;141(1):191-203. doi: 10.1021/jacs.8b07911. Epub 2018 Dec 20.
14 Chemoproteomic capture of RNA binding activity in living cells. Nat Commun. 2023 Oct 7;14(1):6282. doi: 10.1038/s41467-023-41844-z.
Mass spectrometry data entry: PXD044625
15 A Chemical Proteomic Map of Heme-Protein Interactions. J Am Chem Soc. 2022 Aug 24;144(33):15013-15019. doi: 10.1021/jacs.2c06104. Epub 2022 Aug 12.
Mass spectrometry data entry: PXD034651
16 Chemoproteomic Profiling Reveals Ethacrynic Acid Targets Adenine Nucleotide Translocases to Impair Mitochondrial Function. Mol Pharm. 2018 Jun 4;15(6):2413-2422. doi: 10.1021/acs.molpharmaceut.8b00250. Epub 2018 May 15.
17 Chemoproteomic profiling of kinases in live cells using electrophilic sulfonyl triazole probes. Chem Sci. 2021 Jan 21;12(9):3295-3307. doi: 10.1039/d0sc06623k.
18 Discovery of a Cell-Active SuTEx Ligand of Prostaglandin Reductase 2. Chembiochem. 2021 Jun 15;22(12):2134-2139. doi: 10.1002/cbic.202000879. Epub 2021 Apr 29.
19 Global targeting of functional tyrosines using sulfur-triazole exchange chemistry. Nat Chem Biol. 2020 Feb;16(2):150-159. doi: 10.1038/s41589-019-0404-5. Epub 2019 Nov 25.
20 Reimagining high-throughput profiling of reactive cysteines for cell-based screening of large electrophile libraries. Nat Biotechnol. 2021 May;39(5):630-641. doi: 10.1038/s41587-020-00778-3. Epub 2021 Jan 4.
21 Global profiling of functional histidines in live cells using small-molecule photosensitizer and chemical probe relay labelling. Nat Chem. 2024 Jun 4. doi: 10.1038/s41557-024-01545-6. Online ahead of print.
Mass spectrometry data entry: PXD042377
22 Targeted Proteomic Approaches for Proteome-Wide Characterizations of the AMP-Binding Capacities of Kinases. J Proteome Res. 2022 Aug 5;21(8):2063-2070. doi: 10.1021/acs.jproteome.2c00225. Epub 2022 Jul 12.
23 Enhancing Cysteine Chemoproteomic Coverage through Systematic Assessment of Click Chemistry Product Fragmentation. Anal Chem. 2022 Mar 8;94(9):3800-3810. doi: 10.1021/acs.analchem.1c04402. Epub 2022 Feb 23.
Mass spectrometry data entry: PXD028853
24 SP3-FAIMS Chemoproteomics for High-Coverage Profiling of the Human Cysteinome*. Chembiochem. 2021 May 14;22(10):1841-1851. doi: 10.1002/cbic.202000870. Epub 2021 Feb 18.
Mass spectrometry data entry: PXD023056 , PXD023059 , PXD023058 , PXD023057 , PXD023060
25 SP3-Enabled Rapid and High Coverage Chemoproteomic Identification of Cell-State-Dependent Redox-Sensitive Cysteines. Mol Cell Proteomics. 2022 Apr;21(4):100218. doi: 10.1016/j.mcpro.2022.100218. Epub 2022 Feb 25.
Mass spectrometry data entry: PXD029500 , PXD031647
26 Unveiling the Multifaceted Capabilities of Endophytic Aspergillus flavus Isolated from Annona squamosa Fruit Peels against Staphylococcus Isolates and HCoV 229E-In Vitro and In Silico Investigations. Pharmaceuticals (Basel). 2024 May 19;17(5):656. doi: 10.3390/ph17050656.
Mass spectrometry data entry: PXD013019
27 Comparison of Quantitative Mass Spectrometry Platforms for Monitoring Kinase ATP Probe Uptake in Lung Cancer. J Proteome Res. 2018 Jan 5;17(1):63-75. doi: 10.1021/acs.jproteome.7b00329. Epub 2017 Nov 22.
Mass spectrometry data entry: PXD006095 , PXD006096
28 A modification-centric assessment tool for the performance of chemoproteomic probes. Nat Chem Biol. 2022 Aug;18(8):904-912. doi: 10.1038/s41589-022-01074-8. Epub 2022 Jul 21.
Mass spectrometry data entry: PXD027758 , PXD027755 , PXD027760 , PXD027762 , PXD027756 , PXD027591 , PXD007149 , PXD030064 , PXD032392 , PXD027789 , PXD027767 , PXD027764
29 Chemoproteomic Profiling by Cysteine Fluoroalkylation Reveals Myrocin G as an Inhibitor of the Nonhomologous End Joining DNA Repair Pathway. J Am Chem Soc. 2021 Dec 8;143(48):20332-20342. doi: 10.1021/jacs.1c09724. Epub 2021 Nov 24.
Mass spectrometry data entry: PXD029255
30 N-Acryloylindole-alkyne (NAIA) enables imaging and profiling new ligandable cysteines and oxidized thiols by chemoproteomics. Nat Commun. 2023 Jun 15;14(1):3564. doi: 10.1038/s41467-023-39268-w.
Mass spectrometry data entry: PXD041264
31 Tunable Amine-Reactive Electrophiles for Selective Profiling of Lysine. Angew Chem Int Ed Engl. 2022 Jan 26;61(5):e202112107. doi: 10.1002/anie.202112107. Epub 2021 Dec 16.
32 Solid Phase Synthesis of Fluorosulfate Containing Macrocycles for Chemoproteomic Workflows. bioRxiv [Preprint]. 2023 Feb 18:2023.02.17.529022. doi: 10.1101/2023.02.17.529022.
Mass spectrometry data entry: PXD039931
33 Site-Specific Activity-Based Protein Profiling Using Phosphonate Handles. Mol Cell Proteomics. 2023 Jan;22(1):100455. doi: 10.1016/j.mcpro.2022.100455. Epub 2022 Nov 24.
Mass spectrometry data entry: PXD036569
34 DFT-Guided Discovery of Ethynyl-Triazolyl-Phosphinates as Modular Electrophiles for Chemoselective Cysteine Bioconjugation and Profiling. Angew Chem Int Ed Engl. 2022 Oct 10;61(41):e202205348. doi: 10.1002/anie.202205348. Epub 2022 Aug 22.
Mass spectrometry data entry: PXD033004
35 Oxidative cyclization reagents reveal tryptophan cation- interactions. Nature. 2024 Mar;627(8004):680-687. doi: 10.1038/s41586-024-07140-6. Epub 2024 Mar 6.
Mass spectrometry data entry: PXD001377 , PXD005252
36 ACR-Based Probe for the Quantitative Profiling of Histidine Reactivity in the Human Proteome. J Am Chem Soc. 2023 Mar 8;145(9):5252-5260. doi: 10.1021/jacs.2c12653. Epub 2023 Feb 27.
37 Oxidant-Induced Bioconjugation for Protein Labeling in Live Cells. ACS Chem Biol. 2023 Jan 20;18(1):112-122. doi: 10.1021/acschembio.2c00740. Epub 2022 Dec 21.
38 Chemoproteomic profiling of targets of lipid-derived electrophiles by bioorthogonal aminooxy probe. Redox Biol. 2017 Aug;12:712-718. doi: 10.1016/j.redox.2017.04.001. Epub 2017 Apr 5.
39 Differently Tagged Probes for Protein Profiling of Mitochondria. Chembiochem. 2019 May 2;20(9):1155-1160. doi: 10.1002/cbic.201800735. Epub 2019 Mar 26.
40 Activity-based proteome profiling of potential cellular targets of Orlistat--an FDA-approved drug with anti-tumor activities. J Am Chem Soc. 2010 Jan 20;132(2):656-66. doi: 10.1021/ja907716f.
41 Large-scale chemoproteomics expedites ligand discovery and predicts ligand behavior in cells. Science. 2024 Apr 26;384(6694):eadk5864. doi: 10.1126/science.adk5864. Epub 2024 Apr 26.
Mass spectrometry data entry: PXD041587
42 Ligand and Target Discovery by Fragment-Based Screening in Human Cells. Cell. 2017 Jan 26;168(3):527-541.e29. doi: 10.1016/j.cell.2016.12.029. Epub 2017 Jan 19.
43 Pharmacological Targeting of Vacuolar H(+)-ATPase via Subunit V1G Combats Multidrug-Resistant Cancer. Cell Chem Biol. 2020 Nov 19;27(11):1359-1370.e8. doi: 10.1016/j.chembiol.2020.06.011. Epub 2020 Jul 9.
44 A Global Map of Lipid-Binding Proteins and Their Ligandability in Cells. Cell. 2015 Jun 18;161(7):1668-80. doi: 10.1016/j.cell.2015.05.045.
45 Evaluation of fully-functionalized diazirine tags for chemical proteomic applications. Chem Sci. 2021 May 7;12(22):7839-7847. doi: 10.1039/d1sc01360b.
Mass spectrometry data entry: PXD025652
46 Small Molecule Interactome Mapping by Photoaffinity Labeling Reveals Binding Site Hotspots for the NSAIDs. J Am Chem Soc. 2018 Mar 28;140(12):4259-4268. doi: 10.1021/jacs.7b11639. Epub 2018 Mar 15.
Mass spectrometry data entry: PXD007094
47 Mapping Protein Targets of Bioactive Small Molecules Using Lipid-Based Chemical Proteomics. ACS Chem Biol. 2017 Oct 20;12(10):2671-2681. doi: 10.1021/acschembio.7b00581. Epub 2017 Sep 20.
Mass spectrometry data entry: PXD007570
48 Proteome profiling reveals potential cellular targets of staurosporine using a clickable cell-permeable probe. Chem Commun (Camb). 2011 Oct 28;47(40):11306-8. doi: 10.1039/c1cc14824a. Epub 2011 Sep 16.
49 Nucleophilic covalent ligand discovery for the cysteine redoxome. Nat Chem Biol. 2023 Nov;19(11):1309-1319. doi: 10.1038/s41589-023-01330-5. Epub 2023 May 29.
Mass spectrometry data entry: PXD039908 , PXD029761
50 Covalent Ligand Screening Uncovers a RNF4 E3 Ligase Recruiter for Targeted Protein Degradation Applications. ACS Chem Biol. 2019 Nov 15;14(11):2430-2440. doi: 10.1021/acschembio.8b01083. Epub 2019 May 13.
51 Accelerating multiplexed profiling of protein-ligand interactions: High-throughput plate-based reactive cysteine profiling with minimal input. Cell Chem Biol. 2024 Mar 21;31(3):565-576.e4. doi: 10.1016/j.chembiol.2023.11.015. Epub 2023 Dec 19.
Mass spectrometry data entry: PXD044402
52 Proteome-wide covalent ligand discovery in native biological systems. Nature. 2016 Jun 23;534(7608):570-4. doi: 10.1038/nature18002. Epub 2016 Jun 15.
53 Site-specific quantitative cysteine profiling with data-independent acquisition-based mass spectrometry. Methods Enzymol. 2023;679:295-322. doi: 10.1016/bs.mie.2022.07.037. Epub 2022 Sep 7.
Mass spectrometry data entry: PXD027578