General Information of Target

Target ID LDTP12588
Target Name Isoleucine--tRNA ligase, mitochondrial (IARS2)
Gene Name IARS2
Gene ID 55699
Synonyms
Isoleucine--tRNA ligase, mitochondrial; EC 6.1.1.5; Isoleucyl-tRNA synthetase; IleRS
3D Structure
Download
2D Sequence (FASTA)
Download
3D Structure (PDB)
Download
Sequence
MVLCVQGPRPLLAVERTGQRPLWAPSLELPKPVMQPLPAGAFLEEVAEGTPAQTESEPKV
LDPEEDLLCIAKTFSYLRESGWYWGSITASEARQHLQKMPEGTFLVRDSTHPSYLFTLSV
KTTRGPTNVRIEYADSSFRLDSNCLSRPRILAFPDVVSLVQHYVASCTADTRSDSPDPAP
TPALPMPKEDAPSDPALPAPPPATAVHLKLVQPFVRRSSARSLQHLCRLVINRLVADVDC
LPLPRRMADYLRQYPFQL
Target Bioclass
Enzyme
Family
Class-I aminoacyl-tRNA synthetase family
Subcellular location
Mitochondrion matrix
Function Aminoacyl-tRNA synthetase that catalyzes the specific attachment of isoleucine to its cognate tRNA (tRNA(Ile)).
Uniprot ID
Q9NSE4
Ensemble ID
ENST00000366922.3
HGNC ID
HGNC:29685
ChEMBL ID
CHEMBL4105821

Probe(s) Labeling This Target

ABPP Probe
Click To Hide/Show 34 Probe Related to This Target
Probe name Structure Binding Site(Ratio) Interaction ID Ref
m-APA
 Probe Info 
15.00  LDD0402  [1]
N1
 Probe Info 
100.00  LDD0242  [2]
TH211
 Probe Info 
Y312(20.00); Y260(14.24); Y60(13.86); Y240(6.02)  LDD0257  [3]
TH214
 Probe Info 
Y465(10.80)  LDD0258  [3]
TH216
 Probe Info 
Y543(20.00); Y260(12.10); Y240(9.57); Y975(5.01)  LDD0259  [3]
YN-1
 Probe Info 
100.00  LDD0444  [4]
STPyne
 Probe Info 
K189(8.89); K233(7.33); K241(10.00); K277(3.48)  LDD0277  [5]
BTD
 Probe Info 
C323(0.97)  LDD1699  [6]
Probe 1
 Probe Info 
Y228(18.40); Y260(15.67); Y330(14.35); Y543(7.97)  LDD3495  [7]
HHS-475
 Probe Info 
Y260(1.09)  LDD0265  [8]
DBIA
 Probe Info 
C91(1.04); C521(0.92)  LDD0078  [9]
5E-2FA
 Probe Info 
N.A.  LDD2235  [10]
ATP probe
 Probe Info 
K872(0.00); K189(0.00); K661(0.00); K664(0.00)  LDD0199  [11]
1d-yne
 Probe Info 
N.A.  LDD0358  [12]
4-Iodoacetamidophenylacetylene
 Probe Info 
C1005(0.00); C91(0.00); C155(0.00); C883(0.00)  LDD0038  [13]
IA-alkyne
 Probe Info 
N.A.  LDD0032  [14]
Lodoacetamide azide
 Probe Info 
C1005(0.00); C808(0.00); C155(0.00); C883(0.00)  LDD0037  [13]
Alkyne tyramide
 Probe Info 
Y330(0.00); Y543(0.00); Y993(0.00)  LDD0003  [15]
NAIA_4
 Probe Info 
C91(0.00); C311(0.00); C323(0.00); C364(0.00)  LDD2226  [16]
TFBX
 Probe Info 
N.A.  LDD0027  [17]
IPM
 Probe Info 
C883(0.00); C91(0.00)  LDD0005  [15]
NHS
 Probe Info 
K233(0.00); K277(0.00); K241(0.00); K74(0.00)  LDD0010  [15]
PPMS
 Probe Info 
N.A.  LDD0008  [15]
SF
 Probe Info 
N.A.  LDD0028  [18]
Phosphinate-6
 Probe Info 
N.A.  LDD0018  [19]
Ox-W18
 Probe Info 
N.A.  LDD2175  [20]
1c-yne
 Probe Info 
K540(0.00); K667(0.00); K500(0.00); K445(0.00)  LDD0228  [12]
Acrolein
 Probe Info 
C155(0.00); C1002(0.00); C808(0.00); H51(0.00)  LDD0217  [21]
Crotonaldehyde
 Probe Info 
H51(0.00); H264(0.00)  LDD0219  [21]
Methacrolein
 Probe Info 
N.A.  LDD0218  [21]
W1
 Probe Info 
N.A.  LDD0236  [22]
NAIA_5
 Probe Info 
C155(0.00); C883(0.00); C521(0.00); C819(0.00)  LDD2223  [16]
HHS-465
 Probe Info 
K500(0.00); Y260(0.00); Y60(0.00)  LDD2240  [23]
HHS-482
 Probe Info 
Y260(0.77)  LDD2239  [24]
PAL-AfBPP Probe
Click To Hide/Show 17 Probe Related to This Target
Probe name Structure Binding Site(Ratio) Interaction ID Ref
C017
 Probe Info 
6.06  LDD1725  [25]
C158
 Probe Info 
9.45  LDD1838  [25]
C239
 Probe Info 
6.63  LDD1912  [25]
C244
 Probe Info 
14.93  LDD1917  [25]
C285
 Probe Info 
25.11  LDD1955  [25]
C338
 Probe Info 
17.27  LDD2001  [25]
C367
 Probe Info 
5.21  LDD2028  [25]
FFF probe13
 Probe Info 
15.23  LDD0475  [26]
FFF probe14
 Probe Info 
12.99  LDD0477  [26]
FFF probe2
 Probe Info 
18.19  LDD0463  [26]
FFF probe3
 Probe Info 
9.16  LDD0464  [26]
FFF probe6
 Probe Info 
8.48  LDD0467  [26]
JN0003
 Probe Info 
12.77  LDD0469  [26]
VE-P
 Probe Info 
N.A.  LDD0396  [27]
DA-2
 Probe Info 
N.A.  LDD0071  [28]
OEA-DA
 Probe Info 
4.06  LDD0046  [29]
STS-1
 Probe Info 
N.A.  LDD0068  [30]

Competitor(s) Related to This Target

Competitor ID Name Cell line Binding Site(Ratio) Interaction ID Ref
 LDCM0519  1-(6-methoxy-3,4-dihydroquinolin-1(2H)-yl)-2-nitroethan-1-one MDA-MB-231 C883(1.02)  LDD2112  [6]
 LDCM0524  2-Cyano-N-(2-morpholin-4-yl-ethyl)-acetamide MDA-MB-231 C883(1.17); C323(0.90); C521(0.82)  LDD2117  [6]
 LDCM0510  3-(4-(Hydroxydiphenylmethyl)piperidin-1-yl)-3-oxopropanenitrile MDA-MB-231 C883(0.79)  LDD2103  [6]
 LDCM0026  4SU-RNA+native RNA HEK-293T C1005(2.09); C155(2.98)  LDD0372  [31]
 LDCM0214  AC1 HCT 116 C155(1.17); C211(1.23); C883(1.02)  LDD0531  [9]
 LDCM0215  AC10 HCT 116 C155(0.95); C211(1.17); C521(0.87); C883(1.13)  LDD0532  [9]
 LDCM0216  AC100 HCT 116 C155(0.89); C521(0.92); C883(0.97); C91(0.93)  LDD0533  [9]
 LDCM0217  AC101 HCT 116 C155(0.96); C521(1.06); C883(0.98); C91(0.87)  LDD0534  [9]
 LDCM0218  AC102 HCT 116 C155(0.99); C521(0.97); C883(0.89); C91(0.84)  LDD0535  [9]
 LDCM0219  AC103 HCT 116 C155(1.03); C521(1.19); C883(0.98); C91(1.06)  LDD0536  [9]
 LDCM0220  AC104 HCT 116 C155(0.95); C521(0.96); C883(0.98); C91(1.09)  LDD0537  [9]
 LDCM0221  AC105 HCT 116 C155(1.05); C521(1.04); C883(0.90); C91(1.50)  LDD0538  [9]
 LDCM0222  AC106 HCT 116 C155(1.08); C521(0.75); C883(0.91); C91(0.88)  LDD0539  [9]
 LDCM0223  AC107 HCT 116 C155(1.01); C521(0.85); C883(0.92); C91(1.01)  LDD0540  [9]
 LDCM0224  AC108 HCT 116 C155(0.97); C521(0.84); C883(0.82); C91(1.04)  LDD0541  [9]
 LDCM0225  AC109 HCT 116 C155(0.96); C521(0.79); C883(0.80); C91(1.15)  LDD0542  [9]
 LDCM0226  AC11 HCT 116 C155(0.95); C211(1.14); C521(1.09); C883(1.03)  LDD0543  [9]
 LDCM0227  AC110 HCT 116 C155(1.06); C521(0.82); C883(0.82); C91(1.00)  LDD0544  [9]
 LDCM0228  AC111 HCT 116 C155(0.97); C521(0.79); C883(0.77); C91(0.85)  LDD0545  [9]
 LDCM0229  AC112 HCT 116 C155(1.00); C521(0.89); C883(0.78); C91(1.05)  LDD0546  [9]
 LDCM0230  AC113 HCT 116 C155(1.11); C521(0.93); C883(0.90)  LDD0547  [9]
 LDCM0231  AC114 HCT 116 C155(1.12); C521(0.85); C883(1.10)  LDD0548  [9]
 LDCM0232  AC115 HCT 116 C155(1.22); C521(0.99); C883(1.11)  LDD0549  [9]
 LDCM0233  AC116 HCT 116 C155(1.32); C521(0.94); C883(1.01)  LDD0550  [9]
 LDCM0234  AC117 HCT 116 C155(1.20); C521(1.06); C883(1.11)  LDD0551  [9]
 LDCM0235  AC118 HCT 116 C155(1.10); C521(0.94); C883(1.34)  LDD0552  [9]
 LDCM0236  AC119 HCT 116 C155(1.00); C521(1.03); C883(1.03)  LDD0553  [9]
 LDCM0237  AC12 HCT 116 C155(0.98); C211(1.23); C521(1.03); C883(0.99)  LDD0554  [9]
 LDCM0238  AC120 HCT 116 C155(1.15); C521(0.93); C883(1.04)  LDD0555  [9]
 LDCM0239  AC121 HCT 116 C155(1.27); C521(0.87); C883(0.92)  LDD0556  [9]
 LDCM0240  AC122 HCT 116 C155(1.14); C521(1.14); C883(0.88)  LDD0557  [9]
 LDCM0241  AC123 HCT 116 C155(1.09); C521(0.82); C883(0.97)  LDD0558  [9]
 LDCM0242  AC124 HCT 116 C155(1.13); C521(0.87); C883(0.91)  LDD0559  [9]
 LDCM0243  AC125 HCT 116 C155(1.23); C521(0.73); C883(1.33)  LDD0560  [9]
 LDCM0244  AC126 HCT 116 C155(1.26); C521(0.86); C883(0.96)  LDD0561  [9]
 LDCM0245  AC127 HCT 116 C155(1.35); C521(0.92); C883(0.99)  LDD0562  [9]
 LDCM0246  AC128 HCT 116 C155(0.98); C883(1.19)  LDD0563  [9]
 LDCM0247  AC129 HCT 116 C155(0.88); C883(1.02)  LDD0564  [9]
 LDCM0249  AC130 HCT 116 C155(1.11); C883(1.11)  LDD0566  [9]
 LDCM0250  AC131 HCT 116 C155(0.96); C883(0.94)  LDD0567  [9]
 LDCM0251  AC132 HCT 116 C155(0.97); C883(1.05)  LDD0568  [9]
 LDCM0252  AC133 HCT 116 C155(1.07); C883(0.94)  LDD0569  [9]
 LDCM0253  AC134 HCT 116 C155(1.09); C883(1.01)  LDD0570  [9]
 LDCM0254  AC135 HCT 116 C155(1.06); C883(1.03)  LDD0571  [9]
 LDCM0255  AC136 HCT 116 C155(1.07); C883(1.00)  LDD0572  [9]
 LDCM0256  AC137 HCT 116 C155(1.05); C883(0.93)  LDD0573  [9]
 LDCM0257  AC138 HCT 116 C155(1.07); C883(0.90)  LDD0574  [9]
 LDCM0258  AC139 HCT 116 C155(1.07); C883(1.04)  LDD0575  [9]
 LDCM0259  AC14 HCT 116 C155(0.99); C211(1.30); C521(1.00); C883(1.14)  LDD0576  [9]
 LDCM0260  AC140 HCT 116 C155(1.14); C883(0.88)  LDD0577  [9]
 LDCM0261  AC141 HCT 116 C155(1.05); C883(1.02)  LDD0578  [9]
 LDCM0262  AC142 HCT 116 C155(0.97); C883(0.89)  LDD0579  [9]
 LDCM0263  AC143 HCT 116 C155(1.09); C521(1.02); C883(0.91)  LDD0580  [9]
 LDCM0264  AC144 HCT 116 C155(1.03); C521(1.07); C883(1.40)  LDD0581  [9]
 LDCM0265  AC145 HCT 116 C521(0.89); C155(1.02); C883(1.09)  LDD0582  [9]
 LDCM0266  AC146 HCT 116 C521(0.80); C155(1.09); C883(1.13)  LDD0583  [9]
 LDCM0267  AC147 HCT 116 C521(0.93); C155(1.08); C883(1.15)  LDD0584  [9]
 LDCM0268  AC148 HCT 116 C521(0.98); C883(1.03); C155(1.18)  LDD0585  [9]
 LDCM0269  AC149 HCT 116 C155(1.10); C521(1.27); C883(1.38)  LDD0586  [9]
 LDCM0270  AC15 HCT 116 C521(0.98); C155(1.02); C883(1.05); C211(1.30)  LDD0587  [9]
 LDCM0271  AC150 HCT 116 C155(0.99); C521(1.04); C883(1.23)  LDD0588  [9]
 LDCM0272  AC151 HCT 116 C155(0.85); C521(0.87); C883(0.99)  LDD0589  [9]
 LDCM0273  AC152 HCT 116 C521(0.93); C155(1.13); C883(1.23)  LDD0590  [9]
 LDCM0274  AC153 HCT 116 C883(0.92); C521(0.93); C155(0.96)  LDD0591  [9]
 LDCM0621  AC154 HCT 116 C155(1.01); C521(0.94); C883(1.33)  LDD2158  [9]
 LDCM0622  AC155 HCT 116 C155(1.03); C521(0.93); C883(1.21)  LDD2159  [9]
 LDCM0623  AC156 HCT 116 C155(0.94); C521(0.98); C883(1.12)  LDD2160  [9]
 LDCM0624  AC157 HCT 116 C155(0.90); C521(0.97); C883(1.06)  LDD2161  [9]
 LDCM0276  AC17 HCT 116 C883(1.03)  LDD0593  [9]
 LDCM0277  AC18 HCT 116 C883(1.03)  LDD0594  [9]
 LDCM0278  AC19 HCT 116 C883(1.05)  LDD0595  [9]
 LDCM0279  AC2 HCT 116 C883(1.14); C155(1.16); C211(1.23)  LDD0596  [9]
 LDCM0280  AC20 HCT 116 C883(0.91)  LDD0597  [9]
 LDCM0281  AC21 HCT 116 C883(1.03)  LDD0598  [9]
 LDCM0282  AC22 HCT 116 C883(0.81)  LDD0599  [9]
 LDCM0283  AC23 HCT 116 C883(0.77)  LDD0600  [9]
 LDCM0284  AC24 HCT 116 C883(0.97)  LDD0601  [9]
 LDCM0285  AC25 HCT 116 C883(1.05); C155(1.07); C521(1.18)  LDD0602  [9]
 LDCM0286  AC26 HCT 116 C521(0.92); C883(1.19); C155(1.24)  LDD0603  [9]
 LDCM0287  AC27 HCT 116 C521(0.88); C883(1.14); C155(1.18)  LDD0604  [9]
 LDCM0288  AC28 HCT 116 C521(0.80); C883(1.10); C155(1.13)  LDD0605  [9]
 LDCM0289  AC29 HCT 116 C883(1.08); C155(1.21); C521(1.29)  LDD0606  [9]
 LDCM0290  AC3 HCT 116 C883(1.09); C155(1.13); C211(1.34)  LDD0607  [9]
 LDCM0291  AC30 HCT 116 C521(1.00); C155(1.10); C883(1.13)  LDD0608  [9]
 LDCM0292  AC31 HCT 116 C521(1.02); C155(1.09); C883(1.15)  LDD0609  [9]
 LDCM0293  AC32 HCT 116 C521(0.89); C883(1.22); C155(1.26)  LDD0610  [9]
 LDCM0294  AC33 HCT 116 C521(0.91); C883(1.20); C155(1.21)  LDD0611  [9]
 LDCM0295  AC34 HCT 116 C521(0.91); C883(1.16); C155(1.21)  LDD0612  [9]
 LDCM0296  AC35 HCT 116 C91(0.95); C155(1.07)  LDD0613  [9]
 LDCM0297  AC36 HCT 116 C155(1.04); C91(1.22)  LDD0614  [9]
 LDCM0298  AC37 HCT 116 C155(0.97); C91(1.26)  LDD0615  [9]
 LDCM0299  AC38 HCT 116 C155(1.01); C91(2.60)  LDD0616  [9]
 LDCM0300  AC39 HCT 116 C155(1.14); C91(1.22)  LDD0617  [9]
 LDCM0301  AC4 HCT 116 C155(1.18); C883(1.21); C211(1.24)  LDD0618  [9]
 LDCM0302  AC40 HCT 116 C155(0.91); C91(1.34)  LDD0619  [9]
 LDCM0303  AC41 HCT 116 C155(1.01); C91(1.29)  LDD0620  [9]
 LDCM0304  AC42 HCT 116 C155(1.07); C91(1.30)  LDD0621  [9]
 LDCM0305  AC43 HCT 116 C155(1.08); C91(1.64)  LDD0622  [9]
 LDCM0306  AC44 HCT 116 C155(1.03); C91(1.44)  LDD0623  [9]
 LDCM0307  AC45 HCT 116 C155(0.98); C91(1.41)  LDD0624  [9]
 LDCM0308  AC46 HCT 116 C883(0.89); C521(0.96); C91(1.00); C155(1.04)  LDD0625  [9]
 LDCM0309  AC47 HCT 116 C91(0.88); C521(0.94); C155(0.95); C883(0.97)  LDD0626  [9]
 LDCM0310  AC48 HCT 116 C155(0.86); C883(1.00); C521(1.08); C91(1.28)  LDD0627  [9]
 LDCM0311  AC49 HCT 116 C91(0.70); C521(0.99); C155(1.04); C883(1.05)  LDD0628  [9]
 LDCM0312  AC5 HCT 116 C155(1.09); C883(1.11); C211(1.28)  LDD0629  [9]
 LDCM0313  AC50 HCT 116 C91(0.72); C155(0.97); C883(0.97); C521(0.97)  LDD0630  [9]
 LDCM0314  AC51 HCT 116 C883(0.85); C155(0.98); C91(1.02); C521(1.10)  LDD0631  [9]
 LDCM0315  AC52 HCT 116 C91(0.86); C155(0.97); C521(0.97); C883(1.08)  LDD0632  [9]
 LDCM0316  AC53 HCT 116 C521(0.92); C155(0.94); C883(1.00); C91(1.08)  LDD0633  [9]
 LDCM0317  AC54 HCT 116 C91(0.81); C155(0.94); C883(0.96); C521(1.07)  LDD0634  [9]
 LDCM0318  AC55 HCT 116 C91(0.68); C883(0.90); C155(0.97); C521(1.24)  LDD0635  [9]
 LDCM0319  AC56 HCT 116 C91(0.45); C883(0.52); C155(1.01); C521(1.20)  LDD0636  [9]
 LDCM0320  AC57 HCT 116 C155(0.90); C883(1.50)  LDD0637  [9]
 LDCM0321  AC58 HCT 116 C155(0.95); C883(1.66)  LDD0638  [9]
 LDCM0322  AC59 HCT 116 C155(0.93); C883(1.55)  LDD0639  [9]
 LDCM0323  AC6 HCT 116 C155(0.99); C521(1.07); C883(1.09); C211(1.10)  LDD0640  [9]
 LDCM0324  AC60 HCT 116 C155(0.90); C883(1.53)  LDD0641  [9]
 LDCM0325  AC61 HCT 116 C155(0.85); C883(1.52)  LDD0642  [9]
 LDCM0326  AC62 HCT 116 C155(0.90); C883(1.53)  LDD0643  [9]
 LDCM0327  AC63 HCT 116 C155(0.98); C883(1.34)  LDD0644  [9]
 LDCM0328  AC64 HCT 116 C155(0.90); C883(1.61)  LDD0645  [9]
 LDCM0329  AC65 HCT 116 C155(0.93); C883(1.71)  LDD0646  [9]
 LDCM0330  AC66 HCT 116 C155(0.90); C883(2.01)  LDD0647  [9]
 LDCM0331  AC67 HCT 116 C155(0.93); C883(1.27)  LDD0648  [9]
 LDCM0332  AC68 HCT 116 C521(0.65); C883(1.02); C155(1.06)  LDD0649  [9]
 LDCM0333  AC69 HCT 116 C521(0.68); C883(0.97); C155(0.99)  LDD0650  [9]
 LDCM0334  AC7 HCT 116 C883(0.92); C155(0.93); C211(1.14); C521(1.17)  LDD0651  [9]
 LDCM0335  AC70 HCT 116 C521(0.83); C155(0.94); C883(1.27)  LDD0652  [9]
 LDCM0336  AC71 HCT 116 C521(0.70); C155(1.07); C883(1.10)  LDD0653  [9]
 LDCM0337  AC72 HCT 116 C521(0.68); C883(1.01); C155(1.11)  LDD0654  [9]
 LDCM0338  AC73 HCT 116 C883(0.70); C155(0.79); C521(0.82)  LDD0655  [9]
 LDCM0339  AC74 HCT 116 C155(0.78); C521(0.84); C883(0.92)  LDD0656  [9]
 LDCM0340  AC75 HCT 116 C883(0.56); C155(0.57); C521(0.83)  LDD0657  [9]
 LDCM0341  AC76 HCT 116 C521(0.76); C883(1.00); C155(1.05)  LDD0658  [9]
 LDCM0342  AC77 HCT 116 C521(0.76); C883(0.79); C155(1.06)  LDD0659  [9]
 LDCM0343  AC78 HCT 116 C521(0.74); C883(0.95); C155(0.95)  LDD0660  [9]
 LDCM0344  AC79 HCT 116 C521(0.78); C883(0.85); C155(1.08)  LDD0661  [9]
 LDCM0345  AC8 HCT 116 C155(0.90); C883(0.99); C521(1.08); C211(1.24)  LDD0662  [9]
 LDCM0346  AC80 HCT 116 C521(0.83); C883(0.92); C155(1.04)  LDD0663  [9]
 LDCM0347  AC81 HCT 116 C521(0.68); C883(0.75); C155(0.89)  LDD0664  [9]
 LDCM0348  AC82 HCT 116 C883(0.30); C155(0.40); C521(0.76)  LDD0665  [9]
 LDCM0349  AC83 HCT 116 C883(0.92); C155(1.20)  LDD0666  [9]
 LDCM0350  AC84 HCT 116 C883(0.91); C155(1.09)  LDD0667  [9]
 LDCM0351  AC85 HCT 116 C883(0.91); C155(1.13)  LDD0668  [9]
 LDCM0352  AC86 HCT 116 C883(0.87); C155(1.04)  LDD0669  [9]
 LDCM0353  AC87 HCT 116 C883(0.94); C155(1.08)  LDD0670  [9]
 LDCM0354  AC88 HCT 116 C883(0.82); C155(1.05)  LDD0671  [9]
 LDCM0355  AC89 HCT 116 C883(0.98); C155(1.04)  LDD0672  [9]
 LDCM0357  AC90 HCT 116 C883(0.82); C155(0.95)  LDD0674  [9]
 LDCM0358  AC91 HCT 116 C883(1.04); C155(1.22)  LDD0675  [9]
 LDCM0359  AC92 HCT 116 C883(0.98); C155(1.05)  LDD0676  [9]
 LDCM0360  AC93 HCT 116 C883(0.88); C155(1.00)  LDD0677  [9]
 LDCM0361  AC94 HCT 116 C883(0.81); C155(1.28)  LDD0678  [9]
 LDCM0362  AC95 HCT 116 C883(0.95); C155(1.09)  LDD0679  [9]
 LDCM0363  AC96 HCT 116 C883(0.94); C155(1.04)  LDD0680  [9]
 LDCM0364  AC97 HCT 116 C883(0.88); C155(1.20)  LDD0681  [9]
 LDCM0365  AC98 HCT 116 C883(0.56); C155(0.72); C91(0.85); C521(1.14)  LDD0682  [9]
 LDCM0366  AC99 HCT 116 C883(0.91); C155(0.93); C91(1.07); C521(1.08)  LDD0683  [9]
 LDCM0248  AKOS034007472 HCT 116 C155(0.97); C211(1.09); C521(1.12); C883(0.97)  LDD0565  [9]
 LDCM0356  AKOS034007680 HCT 116 C155(0.99); C521(1.04); C883(1.10); C211(1.34)  LDD0673  [9]
 LDCM0275  AKOS034007705 HCT 116 C155(0.99); C521(1.01); C211(1.29); C883(1.31)  LDD0592  [9]
 LDCM0156  Aniline NCI-H1299 11.47  LDD0403  [1]
 LDCM0020  ARS-1620 HCC44 C91(1.04); C521(0.92)  LDD0078  [9]
 LDCM0498  BS-3668 MDA-MB-231 C323(0.33)  LDD2091  [6]
 LDCM0108  Chloroacetamide HeLa C155(0.00); C1002(0.00); C883(0.00); C808(0.00)  LDD0222  [21]
 LDCM0367  CL1 HCT 116 C211(0.91); C155(0.94); C883(1.03)  LDD0684  [9]
 LDCM0368  CL10 HCT 116 C155(0.89); C883(0.96); C211(1.18)  LDD0685  [9]
 LDCM0369  CL100 HCT 116 C883(1.08); C155(1.08); C211(1.12)  LDD0686  [9]
 LDCM0370  CL101 HCT 116 C155(0.95); C521(1.02); C883(1.02); C211(1.25)  LDD0687  [9]
 LDCM0371  CL102 HCT 116 C155(1.04); C521(1.07); C883(1.08); C211(1.24)  LDD0688  [9]
 LDCM0372  CL103 HCT 116 C155(0.88); C211(0.93); C521(0.98); C883(1.02)  LDD0689  [9]
 LDCM0373  CL104 HCT 116 C883(0.90); C521(0.91); C155(0.93); C211(1.06)  LDD0690  [9]
 LDCM0374  CL105 HCT 116 C883(1.20)  LDD0691  [9]
 LDCM0375  CL106 HCT 116 C883(0.95)  LDD0692  [9]
 LDCM0376  CL107 HCT 116 C883(1.06)  LDD0693  [9]
 LDCM0377  CL108 HCT 116 C883(1.38)  LDD0694  [9]
 LDCM0378  CL109 HCT 116 C883(0.85)  LDD0695  [9]
 LDCM0379  CL11 HCT 116 C211(0.97); C883(1.00); C155(1.11)  LDD0696  [9]
 LDCM0380  CL110 HCT 116 C883(0.78)  LDD0697  [9]
 LDCM0381  CL111 HCT 116 C883(0.89)  LDD0698  [9]
 LDCM0382  CL112 HCT 116 C521(0.87); C883(0.96); C155(0.99)  LDD0699  [9]
 LDCM0383  CL113 HCT 116 C521(1.06); C883(1.09); C155(1.20)  LDD0700  [9]
 LDCM0384  CL114 HCT 116 C521(0.90); C883(0.91); C155(1.10)  LDD0701  [9]
 LDCM0385  CL115 HCT 116 C521(1.05); C155(1.11); C883(1.12)  LDD0702  [9]
 LDCM0386  CL116 HCT 116 C521(0.86); C883(1.02); C155(1.19)  LDD0703  [9]
 LDCM0387  CL117 HCT 116 C155(0.52); C91(0.58)  LDD0704  [9]
 LDCM0388  CL118 HCT 116 C155(1.00); C91(1.57)  LDD0705  [9]
 LDCM0389  CL119 HCT 116 C155(1.00); C91(1.20)  LDD0706  [9]
 LDCM0390  CL12 HCT 116 C211(0.87); C155(0.91); C883(1.19)  LDD0707  [9]
 LDCM0391  CL120 HCT 116 C155(1.02); C91(1.35)  LDD0708  [9]
 LDCM0392  CL121 HCT 116 C155(0.86); C883(0.97); C521(1.03); C91(1.09)  LDD0709  [9]
 LDCM0393  CL122 HCT 116 C91(0.68); C155(0.84); C883(1.01); C521(1.07)  LDD0710  [9]
 LDCM0394  CL123 HCT 116 C883(0.94); C91(1.09); C155(1.10); C521(1.30)  LDD0711  [9]
 LDCM0395  CL124 HCT 116 C91(0.84); C155(0.91); C883(0.93); C521(0.93)  LDD0712  [9]
 LDCM0396  CL125 HCT 116 C155(0.97); C883(1.14)  LDD0713  [9]
 LDCM0397  CL126 HCT 116 C155(0.96); C883(1.34)  LDD0714  [9]
 LDCM0398  CL127 HCT 116 C155(0.92); C883(1.30)  LDD0715  [9]
 LDCM0399  CL128 HCT 116 C155(0.90); C883(1.53)  LDD0716  [9]
 LDCM0400  CL13 HCT 116 C155(0.91); C883(1.00); C211(1.03)  LDD0717  [9]
 LDCM0401  CL14 HCT 116 C155(1.00); C883(1.05); C211(1.23)  LDD0718  [9]
 LDCM0402  CL15 HCT 116 C211(0.83); C155(1.00); C883(1.18)  LDD0719  [9]
 LDCM0403  CL16 HCT 116 C155(0.91); C521(1.14); C91(1.18); C883(1.20)  LDD0720  [9]
 LDCM0404  CL17 HCT 116 C155(0.98); C521(1.00); C883(1.00); C91(1.56)  LDD0721  [9]
 LDCM0405  CL18 HCT 116 C521(0.96); C155(1.04); C883(1.19); C91(1.87)  LDD0722  [9]
 LDCM0406  CL19 HCT 116 C155(1.02); C521(1.11); C883(1.29); C91(1.39)  LDD0723  [9]
 LDCM0407  CL2 HCT 116 C155(0.89); C883(1.01); C211(1.17)  LDD0724  [9]
 LDCM0408  CL20 HCT 116 C155(1.08); C521(1.10); C883(1.37); C91(1.98)  LDD0725  [9]
 LDCM0409  CL21 HCT 116 C155(1.01); C883(1.07); C521(1.11); C91(1.57)  LDD0726  [9]
 LDCM0410  CL22 HCT 116 C155(0.72); C883(0.74); C521(1.00); C91(1.25)  LDD0727  [9]
 LDCM0411  CL23 HCT 116 C155(1.02); C521(1.02); C883(1.40); C91(2.00)  LDD0728  [9]
 LDCM0412  CL24 HCT 116 C155(0.94); C521(1.00); C883(1.24); C91(1.76)  LDD0729  [9]
 LDCM0413  CL25 HCT 116 C155(0.94); C521(1.25); C883(1.15); C91(1.49)  LDD0730  [9]
 LDCM0414  CL26 HCT 116 C155(0.91); C521(1.09); C883(1.22); C91(1.54)  LDD0731  [9]
 LDCM0415  CL27 HCT 116 C155(1.00); C521(1.01); C883(1.30); C91(2.00)  LDD0732  [9]
 LDCM0416  CL28 HCT 116 C155(0.95); C521(1.06); C883(1.11); C91(1.57)  LDD0733  [9]
 LDCM0417  CL29 HCT 116 C155(1.11); C521(0.96); C883(1.39); C91(1.43)  LDD0734  [9]
 LDCM0418  CL3 HCT 116 C155(0.75); C211(1.07); C883(0.92)  LDD0735  [9]
 LDCM0419  CL30 HCT 116 C155(1.02); C521(1.10); C883(1.14); C91(1.33)  LDD0736  [9]
 LDCM0420  CL31 HCT 116 C155(0.87); C521(0.96); C883(0.84)  LDD0737  [9]
 LDCM0421  CL32 HCT 116 C155(0.93); C521(1.15); C883(0.82)  LDD0738  [9]
 LDCM0422  CL33 HCT 116 C155(1.15); C521(1.43); C883(0.84)  LDD0739  [9]
 LDCM0423  CL34 HCT 116 C155(0.91); C521(1.39); C883(0.86)  LDD0740  [9]
 LDCM0424  CL35 HCT 116 C155(0.88); C521(1.01); C883(0.98)  LDD0741  [9]
 LDCM0425  CL36 HCT 116 C155(0.89); C521(1.41); C883(0.97)  LDD0742  [9]
 LDCM0426  CL37 HCT 116 C155(0.90); C521(0.99); C883(0.92)  LDD0743  [9]
 LDCM0428  CL39 HCT 116 C155(0.89); C521(1.00); C883(1.00)  LDD0745  [9]
 LDCM0429  CL4 HCT 116 C155(0.80); C211(1.01); C883(0.94)  LDD0746  [9]
 LDCM0430  CL40 HCT 116 C155(1.06); C521(1.21); C883(1.07)  LDD0747  [9]
 LDCM0431  CL41 HCT 116 C155(0.85); C521(1.14); C883(1.02)  LDD0748  [9]
 LDCM0432  CL42 HCT 116 C155(0.69); C521(1.14); C883(0.61)  LDD0749  [9]
 LDCM0433  CL43 HCT 116 C155(0.80); C521(0.96); C883(0.93)  LDD0750  [9]
 LDCM0434  CL44 HCT 116 C155(0.87); C521(0.99); C883(0.94)  LDD0751  [9]
 LDCM0435  CL45 HCT 116 C155(0.90); C521(0.95); C883(1.02)  LDD0752  [9]
 LDCM0436  CL46 HCT 116 C155(0.92); C883(0.96)  LDD0753  [9]
 LDCM0437  CL47 HCT 116 C155(0.92); C883(0.97)  LDD0754  [9]
 LDCM0438  CL48 HCT 116 C155(0.92); C883(0.97)  LDD0755  [9]
 LDCM0439  CL49 HCT 116 C155(0.97); C883(0.96)  LDD0756  [9]
 LDCM0440  CL5 HCT 116 C155(0.90); C211(1.15); C883(0.98)  LDD0757  [9]
 LDCM0441  CL50 HCT 116 C155(0.88); C883(0.98)  LDD0758  [9]
 LDCM0442  CL51 HCT 116 C155(0.95); C883(0.87)  LDD0759  [9]
 LDCM0443  CL52 HCT 116 C155(0.93); C883(0.84)  LDD0760  [9]
 LDCM0444  CL53 HCT 116 C155(0.94); C883(0.93)  LDD0761  [9]
 LDCM0445  CL54 HCT 116 C155(0.83); C883(0.84)  LDD0762  [9]
 LDCM0446  CL55 HCT 116 C155(0.91); C883(0.85)  LDD0763  [9]
 LDCM0447  CL56 HCT 116 C155(0.98); C883(0.75)  LDD0764  [9]
 LDCM0448  CL57 HCT 116 C155(0.92); C883(0.74)  LDD0765  [9]
 LDCM0449  CL58 HCT 116 C155(0.99); C883(0.75)  LDD0766  [9]
 LDCM0450  CL59 HCT 116 C155(0.99); C883(0.77)  LDD0767  [9]
 LDCM0451  CL6 HCT 116 C155(0.84); C211(1.00); C883(1.01)  LDD0768  [9]
 LDCM0452  CL60 HCT 116 C155(0.89); C883(0.78)  LDD0769  [9]
 LDCM0453  CL61 HCT 116 C883(1.08)  LDD0770  [9]
 LDCM0454  CL62 HCT 116 C883(0.97)  LDD0771  [9]
 LDCM0455  CL63 HCT 116 C883(1.00)  LDD0772  [9]
 LDCM0456  CL64 HCT 116 C883(1.01)  LDD0773  [9]
 LDCM0457  CL65 HCT 116 C883(1.05)  LDD0774  [9]
 LDCM0458  CL66 HCT 116 C883(1.25)  LDD0775  [9]
 LDCM0459  CL67 HCT 116 C883(0.95)  LDD0776  [9]
 LDCM0460  CL68 HCT 116 C883(0.86)  LDD0777  [9]
 LDCM0461  CL69 HCT 116 C883(0.91)  LDD0778  [9]
 LDCM0462  CL7 HCT 116 C155(0.93); C211(1.03); C883(0.91)  LDD0779  [9]
 LDCM0463  CL70 HCT 116 C883(0.98)  LDD0780  [9]
 LDCM0464  CL71 HCT 116 C883(0.98)  LDD0781  [9]
 LDCM0465  CL72 HCT 116 C883(1.03)  LDD0782  [9]
 LDCM0466  CL73 HCT 116 C883(0.91)  LDD0783  [9]
 LDCM0467  CL74 HCT 116 C883(0.96)  LDD0784  [9]
 LDCM0469  CL76 HCT 116 C155(1.11); C211(1.03); C521(1.14); C883(1.01)  LDD0786  [9]
 LDCM0470  CL77 HCT 116 C155(1.01); C211(1.30); C521(1.46); C883(0.86)  LDD0787  [9]
 LDCM0471  CL78 HCT 116 C155(0.95); C211(0.98); C521(1.30); C883(1.01)  LDD0788  [9]
 LDCM0472  CL79 HCT 116 C155(1.09); C211(1.07); C521(1.22); C883(1.10)  LDD0789  [9]
 LDCM0473  CL8 HCT 116 C155(1.12); C211(0.94); C883(1.22)  LDD0790  [9]
 LDCM0474  CL80 HCT 116 C155(1.06); C211(1.06); C521(1.29); C883(0.93)  LDD0791  [9]
 LDCM0475  CL81 HCT 116 C155(1.13); C211(0.93); C521(1.23); C883(0.88)  LDD0792  [9]
 LDCM0476  CL82 HCT 116 C155(0.92); C211(0.88); C521(1.25); C883(0.91)  LDD0793  [9]
 LDCM0477  CL83 HCT 116 C155(0.93); C211(1.04); C521(1.04); C883(0.93)  LDD0794  [9]
 LDCM0478  CL84 HCT 116 C155(0.88); C211(0.55); C521(1.11); C883(0.81)  LDD0795  [9]
 LDCM0479  CL85 HCT 116 C155(0.89); C211(1.05); C521(1.17); C883(0.85)  LDD0796  [9]
 LDCM0480  CL86 HCT 116 C155(1.01); C211(1.03); C521(1.29); C883(0.99)  LDD0797  [9]
 LDCM0481  CL87 HCT 116 C155(1.03); C211(1.06); C521(1.07); C883(1.03)  LDD0798  [9]
 LDCM0482  CL88 HCT 116 C155(1.08); C211(1.10); C521(1.07); C883(0.98)  LDD0799  [9]
 LDCM0483  CL89 HCT 116 C155(0.90); C211(0.40); C521(1.17); C883(0.66)  LDD0800  [9]
 LDCM0484  CL9 HCT 116 C155(0.86); C211(1.11); C883(1.18)  LDD0801  [9]
 LDCM0485  CL90 HCT 116 C155(1.39); C211(0.85); C521(1.14); C883(0.89)  LDD0802  [9]
 LDCM0486  CL91 HCT 116 C155(1.04); C211(1.01); C883(1.13)  LDD0803  [9]
 LDCM0487  CL92 HCT 116 C155(1.12); C211(0.99); C883(0.96)  LDD0804  [9]
 LDCM0488  CL93 HCT 116 C155(0.97); C211(1.03); C883(1.10)  LDD0805  [9]
 LDCM0489  CL94 HCT 116 C155(1.11); C211(1.25); C883(1.12)  LDD0806  [9]
 LDCM0490  CL95 HCT 116 C155(1.32); C211(1.26); C883(1.06)  LDD0807  [9]
 LDCM0491  CL96 HCT 116 C155(1.02); C211(0.93); C883(0.90)  LDD0808  [9]
 LDCM0492  CL97 HCT 116 C155(1.07); C211(0.97); C883(1.09)  LDD0809  [9]
 LDCM0493  CL98 HCT 116 C155(1.12); C211(1.24); C883(1.08)  LDD0810  [9]
 LDCM0494  CL99 HCT 116 C155(0.97); C211(1.13); C883(1.15)  LDD0811  [9]
 LDCM0189  Compound 16 HEK-293T 10.43  LDD0492  [26]
 LDCM0182  Compound 18 HEK-293T 3.00  LDD0501  [26]
 LDCM0191  Compound 21 HEK-293T 7.02  LDD0493  [26]
 LDCM0190  Compound 34 HEK-293T 11.65  LDD0497  [26]
 LDCM0192  Compound 35 HEK-293T 8.33  LDD0491  [26]
 LDCM0193  Compound 36 HEK-293T 6.32  LDD0494  [26]
 LDCM0194  Compound 37 HEK-293T 11.11  LDD0498  [26]
 LDCM0195  Compound 38 HEK-293T 12.63  LDD0499  [26]
 LDCM0196  Compound 39 HEK-293T 5.56  LDD0496  [26]
 LDCM0181  Compound 41 HEK-293T 3.68  LDD0502  [26]
 LDCM0495  E2913 HEK-293T C1005(0.88); C1002(1.43); C110(0.92); C883(1.02)  LDD1698  [32]
 LDCM0213  Electrophilic fragment 2 MDA-MB-231 C521(6.06); C883(1.93)  LDD1702  [6]
 LDCM0625  F8 Ramos C91(1.02); C521(0.77); C883(0.91); C155(1.16)  LDD2187  [33]
 LDCM0572  Fragment10 Ramos C91(0.79); C521(0.67); C883(1.21)  LDD2189  [33]
 LDCM0573  Fragment11 Ramos C91(4.52); C521(1.56); C883(0.27)  LDD2190  [33]
 LDCM0574  Fragment12 Ramos C91(1.47); C521(0.49); C883(0.93)  LDD2191  [33]
 LDCM0575  Fragment13 Ramos C91(1.03); C521(0.77); C883(0.89)  LDD2192  [33]
 LDCM0576  Fragment14 Ramos C91(0.68); C521(0.44); C883(0.70); C155(0.70)  LDD2193  [33]
 LDCM0579  Fragment20 Ramos C91(1.29); C521(0.43); C883(0.90)  LDD2194  [33]
 LDCM0580  Fragment21 Ramos C91(0.92); C521(0.81); C883(1.05)  LDD2195  [33]
 LDCM0582  Fragment23 Ramos C91(0.43); C521(1.48); C883(0.86)  LDD2196  [33]
 LDCM0578  Fragment27 Ramos C91(0.99); C521(1.07); C883(1.01)  LDD2197  [33]
 LDCM0586  Fragment28 Ramos C91(0.61); C521(1.32); C883(0.85); C155(1.21)  LDD2198  [33]
 LDCM0588  Fragment30 Ramos C91(1.17); C521(0.77); C883(0.71)  LDD2199  [33]
 LDCM0589  Fragment31 Ramos C91(0.92); C521(1.05); C883(0.78)  LDD2200  [33]
 LDCM0590  Fragment32 Ramos C91(0.81); C521(0.39); C883(0.66)  LDD2201  [33]
 LDCM0468  Fragment33 HCT 116 C883(1.00)  LDD0785  [9]
 LDCM0596  Fragment38 Ramos C91(1.92); C521(1.35); C883(0.75)  LDD2203  [33]
 LDCM0566  Fragment4 Ramos C91(0.77); C521(0.51); C883(0.75); C155(0.59)  LDD2184  [33]
 LDCM0427  Fragment51 HCT 116 C155(0.73); C521(1.28); C883(0.79)  LDD0744  [9]
 LDCM0610  Fragment52 Ramos C91(1.40); C883(0.90)  LDD2204  [33]
 LDCM0614  Fragment56 Ramos C91(1.08); C521(1.15); C883(0.91)  LDD2205  [33]
 LDCM0569  Fragment7 Ramos C91(0.76); C521(1.32); C883(0.69); C155(0.53)  LDD2186  [33]
 LDCM0571  Fragment9 Ramos C91(1.01); C521(0.65); C883(0.98)  LDD2188  [33]
 LDCM0117  HHS-0201 DM93 Y260(1.09)  LDD0265  [8]
 LDCM0118  HHS-0301 DM93 Y260(1.06)  LDD0266  [8]
 LDCM0119  HHS-0401 DM93 Y260(2.03)  LDD0267  [8]
 LDCM0120  HHS-0701 DM93 Y260(1.69)  LDD0268  [8]
 LDCM0107  IAA HeLa C155(0.00); C1002(0.00); C808(0.00); H264(0.00)  LDD0221  [21]
 LDCM0022  KB02 HCT 116 C1005(1.29); C155(2.11); C91(2.36); C211(1.74)  LDD0080  [9]
 LDCM0023  KB03 HCT 116 C1005(0.91); C155(1.45); C91(1.73); C211(1.01)  LDD0081  [9]
 LDCM0024  KB05 HCT 116 C1005(1.17); C155(1.15); C91(1.07); C211(0.97)  LDD0082  [9]
 LDCM0509  N-(4-bromo-3,5-dimethylphenyl)-2-nitroacetamide MDA-MB-231 C883(0.80)  LDD2102  [6]
 LDCM0528  N-(4-bromophenyl)-2-cyano-N-phenylacetamide MDA-MB-231 C323(0.33)  LDD2121  [6]
 LDCM0109  NEM HeLa H264(0.00); H654(0.00); H552(0.00); H461(0.00)  LDD0223  [21]
 LDCM0496  Nucleophilic fragment 11a MDA-MB-231 C883(0.89)  LDD2089  [6]
 LDCM0497  Nucleophilic fragment 11b MDA-MB-231 C883(0.98)  LDD2090  [6]
 LDCM0499  Nucleophilic fragment 12b MDA-MB-231 C883(0.83)  LDD2092  [6]
 LDCM0501  Nucleophilic fragment 13b MDA-MB-231 C883(0.94)  LDD2094  [6]
 LDCM0503  Nucleophilic fragment 14b MDA-MB-231 C883(0.77); C323(0.25)  LDD2096  [6]
 LDCM0505  Nucleophilic fragment 15b MDA-MB-231 C883(0.78); C323(0.79)  LDD2098  [6]
 LDCM0506  Nucleophilic fragment 16a MDA-MB-231 C883(1.60)  LDD2099  [6]
 LDCM0508  Nucleophilic fragment 17a MDA-MB-231 C883(1.09)  LDD2101  [6]
 LDCM0511  Nucleophilic fragment 18b MDA-MB-231 C883(0.70)  LDD2104  [6]
 LDCM0512  Nucleophilic fragment 19a MDA-MB-231 C883(0.77)  LDD2105  [6]
 LDCM0513  Nucleophilic fragment 19b MDA-MB-231 C883(0.70)  LDD2106  [6]
 LDCM0514  Nucleophilic fragment 20a MDA-MB-231 C323(1.14)  LDD2107  [6]
 LDCM0515  Nucleophilic fragment 20b MDA-MB-231 C323(0.38)  LDD2108  [6]
 LDCM0516  Nucleophilic fragment 21a MDA-MB-231 C883(1.08)  LDD2109  [6]
 LDCM0517  Nucleophilic fragment 21b MDA-MB-231 C883(1.12)  LDD2110  [6]
 LDCM0518  Nucleophilic fragment 22a MDA-MB-231 C323(0.69)  LDD2111  [6]
 LDCM0521  Nucleophilic fragment 23b MDA-MB-231 C883(0.70)  LDD2114  [6]
 LDCM0523  Nucleophilic fragment 24b MDA-MB-231 C883(0.92); C323(0.49)  LDD2116  [6]
 LDCM0525  Nucleophilic fragment 25b MDA-MB-231 C883(1.00); C323(0.40)  LDD2118  [6]
 LDCM0527  Nucleophilic fragment 26b MDA-MB-231 C883(0.90)  LDD2120  [6]
 LDCM0529  Nucleophilic fragment 27b MDA-MB-231 C883(1.03); C323(0.56)  LDD2122  [6]
 LDCM0530  Nucleophilic fragment 28a MDA-MB-231 C883(1.09); C323(0.88); C521(0.62)  LDD2123  [6]
 LDCM0531  Nucleophilic fragment 28b MDA-MB-231 C883(0.86); C323(0.43)  LDD2124  [6]
 LDCM0532  Nucleophilic fragment 29a MDA-MB-231 C883(1.02); C521(0.98)  LDD2125  [6]
 LDCM0533  Nucleophilic fragment 29b MDA-MB-231 C883(1.12); C323(0.52)  LDD2126  [6]
 LDCM0534  Nucleophilic fragment 30a MDA-MB-231 C883(1.59)  LDD2127  [6]
 LDCM0536  Nucleophilic fragment 31 MDA-MB-231 C883(1.78)  LDD2129  [6]
 LDCM0542  Nucleophilic fragment 37 MDA-MB-231 C883(1.17)  LDD2135  [6]
 LDCM0543  Nucleophilic fragment 38 MDA-MB-231 C883(1.46)  LDD2136  [6]
 LDCM0544  Nucleophilic fragment 39 MDA-MB-231 C883(1.08)  LDD2137  [6]
 LDCM0546  Nucleophilic fragment 40 MDA-MB-231 C883(1.21)  LDD2140  [6]
 LDCM0547  Nucleophilic fragment 41 MDA-MB-231 C883(0.55)  LDD2141  [6]
 LDCM0549  Nucleophilic fragment 43 MDA-MB-231 C323(0.91)  LDD2143  [6]
 LDCM0550  Nucleophilic fragment 5a MDA-MB-231 C883(2.00)  LDD2144  [6]
 LDCM0552  Nucleophilic fragment 6a MDA-MB-231 C883(0.91); C323(0.89)  LDD2146  [6]
 LDCM0553  Nucleophilic fragment 6b MDA-MB-231 C883(1.81)  LDD2147  [6]
 LDCM0555  Nucleophilic fragment 7b MDA-MB-231 C323(0.49)  LDD2149  [6]
 LDCM0557  Nucleophilic fragment 8b MDA-MB-231 C883(1.05); C323(0.69)  LDD2151  [6]
 LDCM0559  Nucleophilic fragment 9b MDA-MB-231 C883(1.39)  LDD2153  [6]
 LDCM0021  THZ1 HCT 116 C1005(1.13); C155(0.93); C1002(0.96); C91(0.98)  LDD2173  [9]

The Interaction Atlas With This Target

The Drug(s) Related To This Target

Investigative
Click To Hide/Show 1 Drug(s) Interacting with This Target
Drug Name Drug Type External ID
Isoleucine Small molecular drug DB00167

References

1 Quantitative and Site-Specific Chemoproteomic Profiling of Targets of Acrolein. Chem Res Toxicol. 2019 Mar 18;32(3):467-473. doi: 10.1021/acs.chemrestox.8b00343. Epub 2019 Jan 15.
2 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.
3 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.
4 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.
5 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
6 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
7 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.
8 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.
9 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.
10 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
11 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.
12 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.
13 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
14 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
15 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
16 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
17 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
18 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
19 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
20 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
21 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.
22 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.
23 Global profiling identifies a stress-responsive tyrosine site on EDC3 regulating biomolecular condensate formation. Cell Chem Biol. 2022 Dec 15;29(12):1709-1720.e7. doi: 10.1016/j.chembiol.2022.11.008. Epub 2022 Dec 6.
Mass spectrometry data entry: PXD038010
24 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.
25 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
26 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.
27 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.
28 Cell-based proteome profiling of potential dasatinib targets by use of affinity-based probes. J Am Chem Soc. 2012 Feb 15;134(6):3001-14. doi: 10.1021/ja208518u. Epub 2012 Feb 1.
29 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
30 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.
31 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
32 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
33 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