Details of the Target

General Information of Target

Target ID LDTP03024
Target Name Plasma membrane calcium-transporting ATPase 1 (ATP2B1)
Gene Name ATP2B1
Gene ID 490
Synonyms
PMCA1; Plasma membrane calcium-transporting ATPase 1; EC 7.2.2.10; Plasma membrane calcium ATPase isoform 1; PMCA1; Plasma membrane calcium pump isoform 1
3D Structure
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2D Sequence (FASTA)
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3D Structure (PDB)
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Sequence
MGDMANNSVAYSGVKNSLKEANHDGDFGITLAELRALMELRSTDALRKIQESYGDVYGIC
TKLKTSPNEGLSGNPADLERREAVFGKNFIPPKKPKTFLQLVWEALQDVTLIILEIAAIV
SLGLSFYQPPEGDNALCGEVSVGEEEGEGETGWIEGAAILLSVVCVVLVTAFNDWSKEKQ
FRGLQSRIEQEQKFTVIRGGQVIQIPVADITVGDIAQVKYGDLLPADGILIQGNDLKIDE
SSLTGESDHVKKSLDKDPLLLSGTHVMEGSGRMVVTAVGVNSQTGIIFTLLGAGGEEEEK
KDEKKKEKKNKKQDGAIENRNKAKAQDGAAMEMQPLKSEEGGDGDEKDKKKANLPKKEKS
VLQGKLTKLAVQIGKAGLLMSAITVIILVLYFVIDTFWVQKRPWLAECTPIYIQYFVKFF
IIGVTVLVVAVPEGLPLAVTISLAYSVKKMMKDNNLVRHLDACETMGNATAICSDKTGTL
TMNRMTVVQAYINEKHYKKVPEPEAIPPNILSYLVTGISVNCAYTSKILPPEKEGGLPRH
VGNKTECALLGLLLDLKRDYQDVRNEIPEEALYKVYTFNSVRKSMSTVLKNSDGSYRIFS
KGASEIILKKCFKILSANGEAKVFRPRDRDDIVKTVIEPMASEGLRTICLAFRDFPAGEP
EPEWDNENDIVTGLTCIAVVGIEDPVRPEVPDAIKKCQRAGITVRMVTGDNINTARAIAT
KCGILHPGEDFLCLEGKDFNRRIRNEKGEIEQERIDKIWPKLRVLARSSPTDKHTLVKGI
IDSTVSDQRQVVAVTGDGTNDGPALKKADVGFAMGIAGTDVAKEASDIILTDDNFTSIVK
AVMWGRNVYDSISKFLQFQLTVNVVAVIVAFTGACITQDSPLKAVQMLWVNLIMDTLASL
ALATEPPTESLLLRKPYGRNKPLISRTMMKNILGHAFYQLVVVFTLLFAGEKFFDIDSGR
NAPLHAPPSEHYTIVFNTFVLMQLFNEINARKIHGERNVFEGIFNNAIFCTIVLGTFVVQ
IIIVQFGGKPFSCSELSIEQWLWSIFLGMGTLLWGQLISTIPTSRLKFLKEAGHGTQKEE
IPEEELAEDVEEIDHAERELRRGQILWFRGLNRIQTQIRVVNAFRSSLYEGLEKPESRSS
IHNFMTHPEFRIEDSEPHIPLIDDTDAEDDAPTKRNSSPPPSPNKNNNAVDSGIHLTIEM
NKSATSSSPGSPLHSLETSL
Target Bioclass
Enzyme
Family
Cation transport ATPase (P-type) (TC 3.A.3) family, Type IIB subfamily
Subcellular location
Cell membrane
Function
Catalyzes the hydrolysis of ATP coupled with the transport of calcium from the cytoplasm to the extracellular space thereby maintaining intracellular calcium homeostasis. Plays a role in blood pressure regulation through regulation of intracellular calcium concentration and nitric oxide production leading to regulation of vascular smooth muscle cells vasoconstriction. Positively regulates bone mineralization through absorption of calcium from the intestine. Plays dual roles in osteoclast differentiation and survival by regulating RANKL-induced calcium oscillations in preosteoclasts and mediating calcium extrusion in mature osteoclasts. Regulates insulin sensitivity through calcium/calmodulin signaling pathway by regulating AKT1 activation and NOS3 activation in endothelial cells. May play a role in synaptic transmission by modulating calcium and proton dynamics at the synaptic vesicles.
Uniprot ID
P20020
Ensemble ID
ENST00000359142.8
HGNC ID
HGNC:814

Probe(s) Labeling This Target

ABPP Probe
Click To Hide/Show 16 Probe Related to This Target
Probe name Structure Binding Site(Ratio) Interaction ID Ref
CY4
 Probe Info  		100.00  LDD0244  [1]
N1
 Probe Info  		100.00  LDD0242  [1]
STPyne
 Probe Info  		K1070(5.00); K601(1.20); K721(2.27); K778(5.88)  LDD0277  [2]
ONAyne
 Probe Info  		K1070(7.14); K773(1.39)  LDD0275  [2]
IPM
 Probe Info  		C649(0.00); C547(0.00)  LDD0241  [3]
Probe 1
 Probe Info  		Y560(16.71); Y849(39.15)  LDD3495  [4]
BTD
 Probe Info  		C649(1.28)  LDD2090  [5]
HHS-465
 Probe Info  		Y220(1.14)  LDD2237  [6]
DBIA
 Probe Info  		C463(3.74); C473(3.74)  LDD0080  [7]
IA-alkyne
 Probe Info  		C547(0.00); C60(0.00); C649(0.00)  LDD0162  [8]
WYneN
 Probe Info  		N.A.  LDD0021  [9]
WYneO
 Probe Info  		N.A.  LDD0022  [9]
SF
 Probe Info  		N.A.  LDD0028  [10]
Acrolein
 Probe Info  		N.A.  LDD0217  [11]
W1
 Probe Info  		N.A.  LDD0236  [3]
NAIA_5
 Probe Info  		C547(0.00); C60(0.00)  LDD2223  [12]
PAL-AfBPP Probe
Click To Hide/Show 18 Probe Related to This Target
Probe name Structure Binding Site(Ratio) Interaction ID Ref
C022
 Probe Info  		7.52  LDD1728  [13]
C091
 Probe Info  		10.63  LDD1782  [13]
C106
 Probe Info  		16.91  LDD1793  [13]
C108
 Probe Info  		8.51  LDD1795  [13]
C153
 Probe Info  		20.25  LDD1834  [13]
C163
 Probe Info  		5.98  LDD1843  [13]
C178
 Probe Info  		18.90  LDD1857  [13]
C277
 Probe Info  		9.92  LDD1947  [13]
C287
 Probe Info  		8.88  LDD1957  [13]
C343
 Probe Info  		11.55  LDD2005  [13]
C376
 Probe Info  		7.41  LDD2036  [13]
C390
 Probe Info  		21.11  LDD2049  [13]
FFF probe11
 Probe Info  		15.64  LDD0471  [14]
FFF probe13
 Probe Info  		19.77  LDD0475  [14]
FFF probe14
 Probe Info  		20.00  LDD0477  [14]
STS-2
 Probe Info  		N.A.  LDD0139  [15]
Alk-rapa
 Probe Info  		2.03  LDD0213  [16]
OEA-DA
 Probe Info  		13.94  LDD0046  [17]

Competitor(s) Related to This Target

Competitor ID Name Cell line Binding Site(Ratio) Interaction ID Ref
 LDCM0548  1-(4-(Benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2-nitroethan-1-one MDA-MB-231 C649(0.81)  LDD2142  [5]
 LDCM0519  1-(6-methoxy-3,4-dihydroquinolin-1(2H)-yl)-2-nitroethan-1-one MDA-MB-231 C649(0.95)  LDD2112  [5]
 LDCM0214  AC1 HCT 116 C463(1.04); C473(1.04); C722(1.02); C733(1.02)  LDD0531  [7]
 LDCM0215  AC10 HCT 116 C463(0.94); C473(0.93); C60(0.87); C722(1.06)  LDD0532  [7]
 LDCM0216  AC100 HCT 116 C463(0.70); C473(0.67); C60(0.49); C722(0.54)  LDD0533  [7]
 LDCM0217  AC101 HCT 116 C463(0.63); C473(0.66); C60(0.53); C722(0.54)  LDD0534  [7]
 LDCM0218  AC102 HCT 116 C463(0.69); C473(0.68); C60(0.82); C722(0.69)  LDD0535  [7]
 LDCM0219  AC103 HCT 116 C463(0.67); C473(0.66); C60(0.46); C722(0.67)  LDD0536  [7]
 LDCM0220  AC104 HCT 116 C463(0.77); C473(0.74); C60(0.90); C722(0.69)  LDD0537  [7]
 LDCM0221  AC105 HCT 116 C463(0.67); C473(0.66); C60(0.61); C722(0.63)  LDD0538  [7]
 LDCM0222  AC106 HCT 116 C463(0.71); C473(0.72); C60(0.55); C722(0.62)  LDD0539  [7]
 LDCM0223  AC107 HCT 116 C463(0.79); C473(0.71); C60(0.71); C722(0.76)  LDD0540  [7]
 LDCM0224  AC108 HCT 116 C463(2.41); C473(0.75); C60(0.50); C722(0.69)  LDD0541  [7]
 LDCM0225  AC109 HCT 116 C463(1.57); C473(0.74); C60(0.83); C722(0.66)  LDD0542  [7]
 LDCM0226  AC11 HCT 116 C463(1.03); C473(1.00); C60(0.76); C722(0.95)  LDD0543  [7]
 LDCM0227  AC110 HCT 116 C463(0.73); C473(0.72); C60(0.49); C722(0.57)  LDD0544  [7]
 LDCM0228  AC111 HCT 116 C463(0.90); C473(0.73); C60(0.49); C722(0.62)  LDD0545  [7]
 LDCM0229  AC112 HCT 116 C463(0.75); C473(0.67); C60(0.48); C722(0.59)  LDD0546  [7]
 LDCM0230  AC113 HCT 116 C463(0.93); C473(0.93); C60(1.26); C722(1.10)  LDD0547  [7]
 LDCM0231  AC114 HCT 116 C463(0.94); C473(0.94); C60(1.27); C722(0.85)  LDD0548  [7]
 LDCM0232  AC115 HCT 116 C463(0.99); C473(0.99); C60(1.29); C722(0.96)  LDD0549  [7]
 LDCM0233  AC116 HCT 116 C463(0.98); C473(0.98); C60(1.30); C722(0.84)  LDD0550  [7]
 LDCM0234  AC117 HCT 116 C463(1.05); C473(1.05); C60(1.51); C722(0.89)  LDD0551  [7]
 LDCM0235  AC118 HCT 116 C463(0.97); C473(0.97); C60(1.25); C722(1.09)  LDD0552  [7]
 LDCM0236  AC119 HCT 116 C463(1.07); C473(1.07); C60(1.45); C722(0.64)  LDD0553  [7]
 LDCM0237  AC12 HCT 116 C463(0.98); C473(0.93); C60(0.87); C722(1.03)  LDD0554  [7]
 LDCM0238  AC120 HCT 116 C463(1.00); C473(1.00); C60(1.17); C722(0.68)  LDD0555  [7]
 LDCM0239  AC121 HCT 116 C463(1.08); C473(1.08); C60(1.54); C722(0.91)  LDD0556  [7]
 LDCM0240  AC122 HCT 116 C463(1.01); C473(1.01); C60(1.14); C722(0.67)  LDD0557  [7]
 LDCM0241  AC123 HCT 116 C463(1.15); C473(1.15); C60(1.24); C722(0.91)  LDD0558  [7]
 LDCM0242  AC124 HCT 116 C463(1.07); C473(1.07); C60(1.56); C722(0.80)  LDD0559  [7]
 LDCM0243  AC125 HCT 116 C463(1.03); C473(1.03); C60(1.42); C722(0.75)  LDD0560  [7]
 LDCM0244  AC126 HCT 116 C463(1.15); C473(1.15); C60(1.41); C722(0.96)  LDD0561  [7]
 LDCM0245  AC127 HCT 116 C463(1.14); C473(1.14); C60(1.29); C722(0.79)  LDD0562  [7]
 LDCM0246  AC128 HCT 116 C463(1.14); C473(1.14); C722(0.91); C733(0.91)  LDD0563  [7]
 LDCM0247  AC129 HCT 116 C463(1.25); C473(1.25); C722(1.29); C733(1.29)  LDD0564  [7]
 LDCM0249  AC130 HCT 116 C463(1.11); C473(1.11); C722(1.15); C733(1.15)  LDD0566  [7]
 LDCM0250  AC131 HCT 116 C463(1.10); C473(1.10); C722(1.17); C733(1.17)  LDD0567  [7]
 LDCM0251  AC132 HCT 116 C463(1.06); C473(1.06); C722(0.93); C733(0.93)  LDD0568  [7]
 LDCM0252  AC133 HCT 116 C463(1.04); C473(1.04); C722(1.36); C733(1.36)  LDD0569  [7]
 LDCM0253  AC134 HCT 116 C463(1.01); C473(1.01); C722(1.29); C733(1.29)  LDD0570  [7]
 LDCM0254  AC135 HCT 116 C463(1.03); C473(1.03); C722(0.99); C733(0.99)  LDD0571  [7]
 LDCM0255  AC136 HCT 116 C463(1.00); C473(1.00); C722(1.07); C733(1.07)  LDD0572  [7]
 LDCM0256  AC137 HCT 116 C463(0.95); C473(0.95); C722(1.11); C733(1.11)  LDD0573  [7]
 LDCM0257  AC138 HCT 116 C463(0.92); C473(0.92); C722(1.01); C733(1.01)  LDD0574  [7]
 LDCM0258  AC139 HCT 116 C463(0.95); C473(0.95); C722(1.20); C733(1.20)  LDD0575  [7]
 LDCM0259  AC14 HCT 116 C463(1.04); C473(0.99); C60(0.67); C722(0.92)  LDD0576  [7]
 LDCM0260  AC140 HCT 116 C463(0.94); C473(0.94); C722(1.13); C733(1.13)  LDD0577  [7]
 LDCM0261  AC141 HCT 116 C463(0.95); C473(0.95); C722(1.08); C733(1.08)  LDD0578  [7]
 LDCM0262  AC142 HCT 116 C463(1.03); C473(1.03); C722(1.31); C733(1.31)  LDD0579  [7]
 LDCM0263  AC143 HCT 116 C463(1.04); C473(1.04); C60(0.80); C722(1.05)  LDD0580  [7]
 LDCM0264  AC144 HCT 116 C60(0.48); C722(1.00); C733(1.00); C463(1.08)  LDD0581  [7]
 LDCM0265  AC145 HCT 116 C60(0.82); C722(1.05); C733(1.05); C463(1.09)  LDD0582  [7]
 LDCM0266  AC146 HCT 116 C60(0.61); C722(0.94); C733(0.94); C463(0.99)  LDD0583  [7]
 LDCM0267  AC147 HCT 116 C60(0.54); C722(0.93); C733(0.93); C463(0.99)  LDD0584  [7]
 LDCM0268  AC148 HCT 116 C60(0.34); C722(0.74); C733(0.74); C463(0.92)  LDD0585  [7]
 LDCM0269  AC149 HCT 116 C60(0.46); C722(0.86); C733(0.86); C463(0.91)  LDD0586  [7]
 LDCM0270  AC15 HCT 116 C60(0.68); C722(0.94); C733(0.94); C463(0.97)  LDD0587  [7]
 LDCM0271  AC150 HCT 116 C60(0.91); C722(1.04); C733(1.04); C463(1.07)  LDD0588  [7]
 LDCM0272  AC151 HCT 116 C60(0.77); C722(1.07); C733(1.07); C463(1.08)  LDD0589  [7]
 LDCM0273  AC152 HCT 116 C60(0.51); C722(0.92); C733(0.92); C463(1.05)  LDD0590  [7]
 LDCM0274  AC153 HCT 116 C60(0.32); C722(0.75); C733(0.75); C463(0.80)  LDD0591  [7]
 LDCM0621  AC154 HCT 116 C463(1.00); C473(1.00); C60(0.60); C722(1.03)  LDD2158  [7]
 LDCM0622  AC155 HCT 116 C463(1.17); C473(1.17); C60(0.70); C722(0.92)  LDD2159  [7]
 LDCM0623  AC156 HCT 116 C463(1.15); C473(1.15); C60(1.06); C722(1.30)  LDD2160  [7]
 LDCM0624  AC157 HCT 116 C463(1.07); C473(1.07); C60(0.96); C722(1.23)  LDD2161  [7]
 LDCM0276  AC17 HCT 116 C722(0.81); C733(0.81); C60(0.87); C473(1.03)  LDD0593  [7]
 LDCM0277  AC18 HCT 116 C722(0.82); C733(0.82); C60(0.93); C473(1.03)  LDD0594  [7]
 LDCM0278  AC19 HCT 116 C60(0.90); C722(0.92); C733(0.92); C463(0.99)  LDD0595  [7]
 LDCM0279  AC2 HCT 116 C722(0.96); C733(0.96); C463(0.96); C473(0.96)  LDD0596  [7]
 LDCM0280  AC20 HCT 116 C722(0.86); C733(0.86); C60(0.98); C463(1.02)  LDD0597  [7]
 LDCM0281  AC21 HCT 116 C722(0.94); C733(0.94); C60(0.94); C463(1.19)  LDD0598  [7]
 LDCM0282  AC22 HCT 116 C60(0.97); C463(1.03); C473(1.05); C722(1.06)  LDD0599  [7]
 LDCM0283  AC23 HCT 116 C722(0.78); C733(0.78); C473(0.97); C463(1.02)  LDD0600  [7]
 LDCM0284  AC24 HCT 116 C722(0.92); C733(0.92); C463(1.03); C60(1.07)  LDD0601  [7]
 LDCM0285  AC25 HCT 116 C60(0.82); C473(0.87); C463(0.88); C722(1.06)  LDD0602  [7]
 LDCM0286  AC26 HCT 116 C60(0.77); C473(0.89); C463(0.91); C722(1.01)  LDD0603  [7]
 LDCM0287  AC27 HCT 116 C60(0.62); C722(0.89); C733(0.89); C473(0.89)  LDD0604  [7]
 LDCM0288  AC28 HCT 116 C60(0.67); C463(0.92); C722(0.94); C733(0.94)  LDD0605  [7]
 LDCM0289  AC29 HCT 116 C60(0.72); C463(0.86); C473(0.89); C722(0.94)  LDD0606  [7]
 LDCM0290  AC3 HCT 116 C722(1.01); C733(1.01); C463(1.02); C473(1.02)  LDD0607  [7]
 LDCM0291  AC30 HCT 116 C60(0.59); C722(0.79); C733(0.79); C473(0.85)  LDD0608  [7]
 LDCM0292  AC31 HCT 116 C60(0.62); C463(0.87); C473(0.90); C722(0.91)  LDD0609  [7]
 LDCM0293  AC32 HCT 116 C60(0.44); C722(0.75); C733(0.75); C473(0.83)  LDD0610  [7]
 LDCM0294  AC33 HCT 116 C60(0.51); C722(0.80); C733(0.80); C463(0.87)  LDD0611  [7]
 LDCM0295  AC34 HCT 116 C60(0.45); C722(0.76); C733(0.76); C463(0.85)  LDD0612  [7]
 LDCM0296  AC35 HCT 116 C722(1.00); C733(1.00); C463(1.06); C473(1.09)  LDD0613  [7]
 LDCM0297  AC36 HCT 116 C473(1.05); C463(1.06); C722(1.23); C733(1.23)  LDD0614  [7]
 LDCM0298  AC37 HCT 116 C473(1.11); C463(1.11); C60(1.16); C722(1.25)  LDD0615  [7]
 LDCM0299  AC38 HCT 116 C463(0.99); C473(0.99); C722(1.07); C733(1.07)  LDD0616  [7]
 LDCM0300  AC39 HCT 116 C722(0.93); C733(0.93); C60(0.95); C473(1.00)  LDD0617  [7]
 LDCM0301  AC4 HCT 116 C722(1.01); C733(1.01); C463(1.14); C473(1.14)  LDD0618  [7]
 LDCM0302  AC40 HCT 116 C722(0.74); C733(0.74); C60(0.82); C473(1.03)  LDD0619  [7]
 LDCM0303  AC41 HCT 116 C463(0.97); C722(0.99); C733(0.99); C473(0.99)  LDD0620  [7]
 LDCM0304  AC42 HCT 116 C722(0.92); C733(0.92); C60(0.96); C473(1.00)  LDD0621  [7]
 LDCM0305  AC43 HCT 116 C722(0.94); C733(0.94); C60(0.96); C473(1.07)  LDD0622  [7]
 LDCM0306  AC44 HCT 116 C722(0.94); C733(0.94); C60(0.97); C463(1.11)  LDD0623  [7]
 LDCM0307  AC45 HCT 116 C722(0.74); C733(0.74); C60(0.74); C463(1.00)  LDD0624  [7]
 LDCM0308  AC46 HCT 116 C473(0.86); C463(0.88); C722(0.93); C733(0.93)  LDD0625  [7]
 LDCM0309  AC47 HCT 116 C473(0.90); C463(0.93); C722(0.96); C733(0.96)  LDD0626  [7]
 LDCM0310  AC48 HCT 116 C473(0.97); C463(0.98); C722(1.06); C733(1.06)  LDD0627  [7]
 LDCM0311  AC49 HCT 116 C722(0.57); C733(0.57); C473(0.64); C463(0.67)  LDD0628  [7]
 LDCM0312  AC5 HCT 116 C722(1.02); C733(1.02); C463(1.12); C473(1.12)  LDD0629  [7]
 LDCM0313  AC50 HCT 116 C722(0.69); C733(0.69); C463(0.79); C473(0.81)  LDD0630  [7]
 LDCM0314  AC51 HCT 116 C473(0.94); C463(0.96); C722(1.35); C733(1.35)  LDD0631  [7]
 LDCM0315  AC52 HCT 116 C473(0.87); C463(0.88); C722(0.91); C733(0.91)  LDD0632  [7]
 LDCM0316  AC53 HCT 116 C722(0.81); C733(0.81); C473(0.81); C463(0.82)  LDD0633  [7]
 LDCM0317  AC54 HCT 116 C722(0.79); C733(0.79); C473(0.79); C463(0.82)  LDD0634  [7]
 LDCM0318  AC55 HCT 116 C722(0.82); C733(0.82); C473(0.84); C463(0.87)  LDD0635  [7]
 LDCM0319  AC56 HCT 116 C722(0.68); C733(0.68); C473(0.79); C463(0.80)  LDD0636  [7]
 LDCM0320  AC57 HCT 116 C60(0.44); C722(0.81); C733(0.81); C463(1.02)  LDD0637  [7]
 LDCM0321  AC58 HCT 116 C60(0.40); C722(0.77); C733(0.77); C463(0.94)  LDD0638  [7]
 LDCM0322  AC59 HCT 116 C60(0.44); C722(0.74); C733(0.74); C463(0.98)  LDD0639  [7]
 LDCM0323  AC6 HCT 116 C60(0.71); C722(0.87); C733(0.87); C463(0.91)  LDD0640  [7]
 LDCM0324  AC60 HCT 116 C60(0.48); C722(0.86); C733(0.86); C463(0.98)  LDD0641  [7]
 LDCM0325  AC61 HCT 116 C60(0.48); C722(0.81); C733(0.81); C463(1.03)  LDD0642  [7]
 LDCM0326  AC62 HCT 116 C60(0.39); C722(0.64); C733(0.64); C463(0.92)  LDD0643  [7]
 LDCM0327  AC63 HCT 116 C60(0.44); C722(0.63); C733(0.63); C463(1.01)  LDD0644  [7]
 LDCM0328  AC64 HCT 116 C60(0.41); C722(0.66); C733(0.66); C463(1.03)  LDD0645  [7]
 LDCM0329  AC65 HCT 116 C60(0.36); C722(0.75); C733(0.75); C463(1.04)  LDD0646  [7]
 LDCM0330  AC66 HCT 116 C60(0.48); C722(0.79); C733(0.79); C463(1.23)  LDD0647  [7]
 LDCM0331  AC67 HCT 116 C60(0.23); C722(0.54); C733(0.54); C463(0.84)  LDD0648  [7]
 LDCM0332  AC68 HCT 116 C463(0.94); C473(0.94); C722(1.04); C733(1.04)  LDD0649  [7]
 LDCM0333  AC69 HCT 116 C722(0.94); C733(0.94); C463(0.94); C473(0.94)  LDD0650  [7]
 LDCM0334  AC7 HCT 116 C60(0.83); C473(0.94); C463(0.96); C722(1.00)  LDD0651  [7]
 LDCM0335  AC70 HCT 116 C463(0.71); C473(0.71); C722(0.77); C733(0.77)  LDD0652  [7]
 LDCM0336  AC71 HCT 116 C463(0.93); C473(0.93); C722(1.09); C733(1.09)  LDD0653  [7]
 LDCM0337  AC72 HCT 116 C463(0.83); C473(0.83); C722(1.07); C733(1.07)  LDD0654  [7]
 LDCM0338  AC73 HCT 116 C463(0.69); C473(0.69); C722(0.77); C733(0.77)  LDD0655  [7]
 LDCM0339  AC74 HCT 116 C463(0.81); C473(0.81); C722(0.88); C733(0.88)  LDD0656  [7]
 LDCM0340  AC75 HCT 116 C463(0.68); C473(0.68); C722(1.03); C733(1.03)  LDD0657  [7]
 LDCM0341  AC76 HCT 116 C463(0.87); C473(0.87); C722(1.05); C733(1.05)  LDD0658  [7]
 LDCM0342  AC77 HCT 116 C463(0.80); C473(0.80); C722(0.98); C733(0.98)  LDD0659  [7]
 LDCM0343  AC78 HCT 116 C463(0.90); C473(0.90); C722(1.14); C733(1.14)  LDD0660  [7]
 LDCM0344  AC79 HCT 116 C463(0.86); C473(0.86); C722(0.94); C733(0.94)  LDD0661  [7]
 LDCM0345  AC8 HCT 116 C722(0.77); C733(0.77); C463(0.95); C473(0.99)  LDD0662  [7]
 LDCM0346  AC80 HCT 116 C722(0.95); C733(0.95); C463(1.01); C473(1.01)  LDD0663  [7]
 LDCM0347  AC81 HCT 116 C463(1.02); C473(1.02); C722(1.04); C733(1.04)  LDD0664  [7]
 LDCM0348  AC82 HCT 116 C463(0.79); C473(0.79); C722(0.86); C733(0.86)  LDD0665  [7]
 LDCM0349  AC83 HCT 116 C463(0.90); C473(0.90); C722(1.29); C733(1.29)  LDD0666  [7]
 LDCM0350  AC84 HCT 116 C463(1.04); C473(1.04); C722(1.17); C733(1.17)  LDD0667  [7]
 LDCM0351  AC85 HCT 116 C463(0.95); C473(0.95); C722(1.01); C733(1.01)  LDD0668  [7]
 LDCM0352  AC86 HCT 116 C463(0.96); C473(0.96); C722(1.07); C733(1.07)  LDD0669  [7]
 LDCM0353  AC87 HCT 116 C463(1.00); C473(1.00); C722(1.03); C733(1.03)  LDD0670  [7]
 LDCM0354  AC88 HCT 116 C722(0.97); C733(0.97); C463(1.02); C473(1.02)  LDD0671  [7]
 LDCM0355  AC89 HCT 116 C463(1.03); C473(1.03); C722(1.24); C733(1.24)  LDD0672  [7]
 LDCM0357  AC90 HCT 116 C463(1.02); C473(1.02); C722(1.03); C733(1.03)  LDD0674  [7]
 LDCM0358  AC91 HCT 116 C463(0.96); C473(0.96); C722(1.86); C733(1.86)  LDD0675  [7]
 LDCM0359  AC92 HCT 116 C463(1.02); C473(1.02); C722(1.31); C733(1.31)  LDD0676  [7]
 LDCM0360  AC93 HCT 116 C463(1.01); C473(1.01); C722(1.03); C733(1.03)  LDD0677  [7]
 LDCM0361  AC94 HCT 116 C463(1.25); C473(1.25); C722(1.76); C733(1.76)  LDD0678  [7]
 LDCM0362  AC95 HCT 116 C722(0.82); C733(0.82); C463(1.06); C473(1.06)  LDD0679  [7]
 LDCM0363  AC96 HCT 116 C463(1.20); C473(1.20); C722(1.48); C733(1.48)  LDD0680  [7]
 LDCM0364  AC97 HCT 116 C463(0.91); C473(0.91); C722(0.93); C733(0.93)  LDD0681  [7]
 LDCM0365  AC98 HCT 116 C60(0.49); C463(0.50); C473(0.50); C722(0.52)  LDD0682  [7]
 LDCM0366  AC99 HCT 116 C60(0.59); C473(0.71); C463(0.72); C722(0.78)  LDD0683  [7]
 LDCM0520  AKOS000195272 MDA-MB-231 C649(1.09)  LDD2113  [5]
 LDCM0248  AKOS034007472 HCT 116 C463(0.90); C473(0.88); C60(1.20); C722(1.01)  LDD0565  [7]
 LDCM0356  AKOS034007680 HCT 116 C60(0.89); C473(0.93); C463(0.93); C722(0.99)  LDD0673  [7]
 LDCM0275  AKOS034007705 HCT 116 C60(0.47); C722(0.77); C733(0.77); C473(0.90)  LDD0592  [7]
 LDCM0108  Chloroacetamide HeLa C60(0.00); C649(0.00)  LDD0222  [11]
 LDCM0367  CL1 HCT 116 C463(1.17); C473(1.17); C722(1.59); C733(1.59)  LDD0684  [7]
 LDCM0368  CL10 HCT 116 C722(0.91); C733(0.91); C463(1.06); C473(1.06)  LDD0685  [7]
 LDCM0369  CL100 HCT 116 C722(0.88); C733(0.88); C463(1.07); C473(1.07)  LDD0686  [7]
 LDCM0370  CL101 HCT 116 C60(0.59); C722(0.92); C733(0.92); C473(0.93)  LDD0687  [7]
 LDCM0371  CL102 HCT 116 C60(0.89); C473(0.92); C463(0.96); C722(1.11)  LDD0688  [7]
 LDCM0372  CL103 HCT 116 C722(0.96); C733(0.96); C473(0.96); C463(1.01)  LDD0689  [7]
 LDCM0373  CL104 HCT 116 C463(0.91); C473(0.93); C722(0.97); C733(0.97)  LDD0690  [7]
 LDCM0374  CL105 HCT 116 C722(0.74); C733(0.74); C60(0.85); C463(0.97)  LDD0691  [7]
 LDCM0375  CL106 HCT 116 C722(0.69); C733(0.69); C60(0.78); C463(1.12)  LDD0692  [7]
 LDCM0376  CL107 HCT 116 C722(0.66); C733(0.66); C60(0.74); C463(1.02)  LDD0693  [7]
 LDCM0377  CL108 HCT 116 C60(0.73); C722(0.78); C733(0.78); C463(1.02)  LDD0694  [7]
 LDCM0378  CL109 HCT 116 C722(0.82); C733(0.82); C60(0.82); C473(0.98)  LDD0695  [7]
 LDCM0379  CL11 HCT 116 C722(0.78); C733(0.78); C463(1.08); C473(1.08)  LDD0696  [7]
 LDCM0380  CL110 HCT 116 C722(0.81); C733(0.81); C60(0.90); C473(1.02)  LDD0697  [7]
 LDCM0381  CL111 HCT 116 C722(0.72); C733(0.72); C60(0.95); C473(1.00)  LDD0698  [7]
 LDCM0382  CL112 HCT 116 C463(0.88); C473(0.91); C60(0.92); C722(1.08)  LDD0699  [7]
 LDCM0383  CL113 HCT 116 C60(0.52); C463(0.82); C722(0.83); C733(0.83)  LDD0700  [7]
 LDCM0384  CL114 HCT 116 C463(0.78); C473(0.79); C60(0.83); C722(1.04)  LDD0701  [7]
 LDCM0385  CL115 HCT 116 C60(0.64); C463(0.83); C473(0.84); C722(0.90)  LDD0702  [7]
 LDCM0386  CL116 HCT 116 C60(0.68); C463(0.82); C473(0.88); C722(0.97)  LDD0703  [7]
 LDCM0387  CL117 HCT 116 C60(0.54); C722(0.54); C733(0.54); C473(0.88)  LDD0704  [7]
 LDCM0388  CL118 HCT 116 C722(0.94); C733(0.94); C60(0.95); C463(1.00)  LDD0705  [7]
 LDCM0389  CL119 HCT 116 C60(0.90); C722(0.95); C733(0.95); C473(1.03)  LDD0706  [7]
 LDCM0390  CL12 HCT 116 C722(0.72); C733(0.72); C463(1.00); C473(1.00)  LDD0707  [7]
 LDCM0391  CL120 HCT 116 C60(1.00); C473(1.01); C463(1.02); C722(1.24)  LDD0708  [7]
 LDCM0392  CL121 HCT 116 C473(1.34); C722(1.49); C733(1.49); C463(1.56)  LDD0709  [7]
 LDCM0393  CL122 HCT 116 C473(0.86); C463(0.90); C722(0.93); C733(0.93)  LDD0710  [7]
 LDCM0394  CL123 HCT 116 C722(0.77); C733(0.77); C473(0.91); C463(0.95)  LDD0711  [7]
 LDCM0395  CL124 HCT 116 C722(0.68); C733(0.68); C473(0.76); C463(0.77)  LDD0712  [7]
 LDCM0396  CL125 HCT 116 C60(0.73); C722(0.92); C733(0.92); C463(0.97)  LDD0713  [7]
 LDCM0397  CL126 HCT 116 C60(0.64); C722(0.99); C733(0.99); C463(0.99)  LDD0714  [7]
 LDCM0398  CL127 HCT 116 C60(0.62); C722(0.82); C733(0.82); C463(0.98)  LDD0715  [7]
 LDCM0399  CL128 HCT 116 C60(0.48); C722(0.79); C733(0.79); C463(1.05)  LDD0716  [7]
 LDCM0400  CL13 HCT 116 C722(1.08); C733(1.08); C463(1.10); C473(1.10)  LDD0717  [7]
 LDCM0401  CL14 HCT 116 C463(1.06); C473(1.06); C722(1.35); C733(1.35)  LDD0718  [7]
 LDCM0402  CL15 HCT 116 C463(1.21); C473(1.21); C722(1.26); C733(1.26)  LDD0719  [7]
 LDCM0403  CL16 HCT 116 C463(0.80); C473(0.80); C722(0.89); C733(0.89)  LDD0720  [7]
 LDCM0404  CL17 HCT 116 C463(0.79); C473(0.79); C722(0.97); C733(0.97)  LDD0721  [7]
 LDCM0405  CL18 HCT 116 C463(0.88); C473(0.88); C722(1.03); C733(1.03)  LDD0722  [7]
 LDCM0406  CL19 HCT 116 C463(0.85); C473(0.85); C722(1.02); C733(1.02)  LDD0723  [7]
 LDCM0407  CL2 HCT 116 C463(1.16); C473(1.16); C722(1.52); C733(1.52)  LDD0724  [7]
 LDCM0408  CL20 HCT 116 C463(0.80); C473(0.80); C722(0.90); C733(0.90)  LDD0725  [7]
 LDCM0409  CL21 HCT 116 C463(0.88); C473(0.88); C722(0.88); C733(0.88)  LDD0726  [7]
 LDCM0410  CL22 HCT 116 C463(0.70); C473(0.70); C722(0.75); C733(0.75)  LDD0727  [7]
 LDCM0411  CL23 HCT 116 C722(0.76); C733(0.76); C463(0.82); C473(0.82)  LDD0728  [7]
 LDCM0412  CL24 HCT 116 C463(0.74); C473(0.74); C722(0.76); C733(0.76)  LDD0729  [7]
 LDCM0413  CL25 HCT 116 C463(0.75); C473(0.75); C722(0.80); C733(0.80)  LDD0730  [7]
 LDCM0414  CL26 HCT 116 C463(0.79); C473(0.79); C722(0.87); C733(0.87)  LDD0731  [7]
 LDCM0415  CL27 HCT 116 C463(0.85); C473(0.85); C722(1.09); C733(1.09)  LDD0732  [7]
 LDCM0416  CL28 HCT 116 C463(0.79); C473(0.79); C722(0.83); C733(0.83)  LDD0733  [7]
 LDCM0417  CL29 HCT 116 C463(0.85); C473(0.85); C722(0.93); C733(0.93)  LDD0734  [7]
 LDCM0418  CL3 HCT 116 C463(1.15); C473(1.15); C722(1.28); C733(1.28)  LDD0735  [7]
 LDCM0419  CL30 HCT 116 C463(0.80); C473(0.80); C722(1.01); C733(1.01)  LDD0736  [7]
 LDCM0420  CL31 HCT 116 C463(1.06); C473(1.05); C60(0.76); C722(0.81)  LDD0737  [7]
 LDCM0421  CL32 HCT 116 C463(0.87); C473(0.92); C60(0.85); C722(0.75)  LDD0738  [7]
 LDCM0422  CL33 HCT 116 C463(0.93); C473(0.93); C60(0.84); C722(0.89)  LDD0739  [7]
 LDCM0423  CL34 HCT 116 C463(0.82); C473(0.83); C60(0.44); C722(0.72)  LDD0740  [7]
 LDCM0424  CL35 HCT 116 C463(0.75); C473(0.75); C60(0.45); C722(0.68)  LDD0741  [7]
 LDCM0425  CL36 HCT 116 C463(0.93); C473(0.93); C60(0.50); C722(0.82)  LDD0742  [7]
 LDCM0426  CL37 HCT 116 C463(0.79); C473(0.81); C60(0.40); C722(0.82)  LDD0743  [7]
 LDCM0428  CL39 HCT 116 C463(0.85); C473(0.85); C60(0.52); C722(0.66)  LDD0745  [7]
 LDCM0429  CL4 HCT 116 C463(1.08); C473(1.08); C722(1.15); C733(1.15)  LDD0746  [7]
 LDCM0430  CL40 HCT 116 C463(0.82); C473(0.83); C60(0.50); C722(0.82)  LDD0747  [7]
 LDCM0431  CL41 HCT 116 C463(0.91); C473(0.93); C60(0.50); C722(0.74)  LDD0748  [7]
 LDCM0432  CL42 HCT 116 C463(0.70); C473(0.70); C60(0.27); C722(0.73)  LDD0749  [7]
 LDCM0433  CL43 HCT 116 C463(0.80); C473(0.79); C60(0.41); C722(0.70)  LDD0750  [7]
 LDCM0434  CL44 HCT 116 C463(0.90); C473(0.91); C60(0.55); C722(0.86)  LDD0751  [7]
 LDCM0435  CL45 HCT 116 C463(0.92); C473(0.93); C60(0.51); C722(0.80)  LDD0752  [7]
 LDCM0436  CL46 HCT 116 C463(1.04); C473(1.04); C722(1.41); C733(1.41)  LDD0753  [7]
 LDCM0437  CL47 HCT 116 C463(1.00); C473(1.00); C722(1.23); C733(1.23)  LDD0754  [7]
 LDCM0438  CL48 HCT 116 C463(0.98); C473(0.98); C722(1.30); C733(1.30)  LDD0755  [7]
 LDCM0439  CL49 HCT 116 C463(1.14); C473(1.14); C722(1.21); C733(1.21)  LDD0756  [7]
 LDCM0440  CL5 HCT 116 C463(1.22); C473(1.22); C722(1.22); C733(1.22)  LDD0757  [7]
 LDCM0441  CL50 HCT 116 C463(0.99); C473(0.99); C722(1.31); C733(1.31)  LDD0758  [7]
 LDCM0442  CL51 HCT 116 C463(1.18); C473(1.18); C722(1.51); C733(1.51)  LDD0759  [7]
 LDCM0443  CL52 HCT 116 C463(0.99); C473(0.99); C722(1.49); C733(1.49)  LDD0760  [7]
 LDCM0444  CL53 HCT 116 C463(0.97); C473(0.97); C722(1.30); C733(1.30)  LDD0761  [7]
 LDCM0445  CL54 HCT 116 C463(1.16); C473(1.16); C722(1.34); C733(1.34)  LDD0762  [7]
 LDCM0446  CL55 HCT 116 C463(1.08); C473(1.08); C722(1.45); C733(1.45)  LDD0763  [7]
 LDCM0447  CL56 HCT 116 C463(1.01); C473(1.01); C722(1.15); C733(1.15)  LDD0764  [7]
 LDCM0448  CL57 HCT 116 C463(1.10); C473(1.10); C722(1.40); C733(1.40)  LDD0765  [7]
 LDCM0449  CL58 HCT 116 C463(1.09); C473(1.09); C722(1.37); C733(1.37)  LDD0766  [7]
 LDCM0450  CL59 HCT 116 C463(1.08); C473(1.08); C722(1.29); C733(1.29)  LDD0767  [7]
 LDCM0451  CL6 HCT 116 C463(1.07); C473(1.07); C722(1.07); C733(1.07)  LDD0768  [7]
 LDCM0452  CL60 HCT 116 C463(0.99); C473(0.99); C722(1.07); C733(1.07)  LDD0769  [7]
 LDCM0453  CL61 HCT 116 C463(0.83); C473(0.90); C722(1.08); C733(1.08)  LDD0770  [7]
 LDCM0454  CL62 HCT 116 C463(0.80); C473(0.82); C722(0.92); C733(0.92)  LDD0771  [7]
 LDCM0455  CL63 HCT 116 C463(0.79); C473(0.85); C722(0.96); C733(0.96)  LDD0772  [7]
 LDCM0456  CL64 HCT 116 C463(0.82); C473(0.85); C722(0.79); C733(0.79)  LDD0773  [7]
 LDCM0457  CL65 HCT 116 C463(0.84); C473(0.89); C722(0.88); C733(0.88)  LDD0774  [7]
 LDCM0458  CL66 HCT 116 C463(0.78); C473(0.83); C722(0.57); C733(0.57)  LDD0775  [7]
 LDCM0459  CL67 HCT 116 C463(0.84); C473(0.91); C722(0.65); C733(0.65)  LDD0776  [7]
 LDCM0460  CL68 HCT 116 C463(0.80); C473(0.83); C722(0.86); C733(0.86)  LDD0777  [7]
 LDCM0461  CL69 HCT 116 C463(0.85); C473(0.93); C722(1.27); C733(1.27)  LDD0778  [7]
 LDCM0462  CL7 HCT 116 C463(1.09); C473(1.09); C722(0.87); C733(0.87)  LDD0779  [7]
 LDCM0463  CL70 HCT 116 C463(0.82); C473(0.90); C722(0.99); C733(0.99)  LDD0780  [7]
 LDCM0464  CL71 HCT 116 C463(0.73); C473(0.80); C722(0.79); C733(0.79)  LDD0781  [7]
 LDCM0465  CL72 HCT 116 C463(0.78); C473(0.82); C722(0.90); C733(0.90)  LDD0782  [7]
 LDCM0466  CL73 HCT 116 C463(0.78); C473(0.82); C722(0.76); C733(0.76)  LDD0783  [7]
 LDCM0467  CL74 HCT 116 C463(0.72); C473(0.78); C722(0.79); C733(0.79)  LDD0784  [7]
 LDCM0469  CL76 HCT 116 C463(1.01); C473(1.01)  LDD0786  [7]
 LDCM0470  CL77 HCT 116 C463(0.90); C473(0.90)  LDD0787  [7]
 LDCM0471  CL78 HCT 116 C463(0.96); C473(0.96)  LDD0788  [7]
 LDCM0472  CL79 HCT 116 C463(0.90); C473(0.90)  LDD0789  [7]
 LDCM0473  CL8 HCT 116 C463(0.90); C473(0.90); C722(0.66); C733(0.66)  LDD0790  [7]
 LDCM0474  CL80 HCT 116 C463(0.99); C473(0.99)  LDD0791  [7]
 LDCM0475  CL81 HCT 116 C463(0.95); C473(0.95)  LDD0792  [7]
 LDCM0476  CL82 HCT 116 C463(0.87); C473(0.87)  LDD0793  [7]
 LDCM0477  CL83 HCT 116 C463(0.91); C473(0.91)  LDD0794  [7]
 LDCM0478  CL84 HCT 116 C463(0.76); C473(0.76)  LDD0795  [7]
 LDCM0479  CL85 HCT 116 C463(0.99); C473(0.99)  LDD0796  [7]
 LDCM0480  CL86 HCT 116 C463(0.98); C473(0.98)  LDD0797  [7]
 LDCM0481  CL87 HCT 116 C463(1.00); C473(1.00)  LDD0798  [7]
 LDCM0482  CL88 HCT 116 C463(1.02); C473(1.02)  LDD0799  [7]
 LDCM0483  CL89 HCT 116 C463(0.80); C473(0.80)  LDD0800  [7]
 LDCM0484  CL9 HCT 116 C463(1.10); C473(1.10); C722(1.05); C733(1.05)  LDD0801  [7]
 LDCM0485  CL90 HCT 116 C463(0.90); C473(0.90)  LDD0802  [7]
 LDCM0486  CL91 HCT 116 C463(1.04); C473(1.04); C722(1.02); C733(1.02)  LDD0803  [7]
 LDCM0487  CL92 HCT 116 C463(0.87); C473(0.87); C722(1.05); C733(1.05)  LDD0804  [7]
 LDCM0488  CL93 HCT 116 C463(0.93); C473(0.93); C722(1.08); C733(1.08)  LDD0805  [7]
 LDCM0489  CL94 HCT 116 C463(1.01); C473(1.01); C722(0.97); C733(0.97)  LDD0806  [7]
 LDCM0490  CL95 HCT 116 C463(0.86); C473(0.86); C722(0.92); C733(0.92)  LDD0807  [7]
 LDCM0491  CL96 HCT 116 C463(0.91); C473(0.91); C722(1.04); C733(1.04)  LDD0808  [7]
 LDCM0492  CL97 HCT 116 C463(0.94); C473(0.94); C722(0.83); C733(0.83)  LDD0809  [7]
 LDCM0493  CL98 HCT 116 C463(0.97); C473(0.97); C722(0.94); C733(0.94)  LDD0810  [7]
 LDCM0494  CL99 HCT 116 C463(1.07); C473(1.07); C722(0.94); C733(0.94)  LDD0811  [7]
 LDCM0495  E2913 HEK-293T C649(1.04); C60(1.12); C547(1.07); C522(1.20)  LDD1698  [18]
 LDCM0213  Electrophilic fragment 2 MDA-MB-231 C649(7.75); C60(5.64)  LDD1702  [5]
 LDCM0625  F8 Ramos C60(0.68)  LDD2187  [19]
 LDCM0572  Fragment10 Ramos C60(0.67)  LDD2189  [19]
 LDCM0573  Fragment11 Ramos C60(3.75)  LDD2190  [19]
 LDCM0574  Fragment12 Ramos C60(0.70)  LDD2191  [19]
 LDCM0575  Fragment13 Ramos C60(0.62)  LDD2192  [19]
 LDCM0579  Fragment20 Ramos C60(0.73)  LDD2194  [19]
 LDCM0580  Fragment21 Ramos C60(0.70)  LDD2195  [19]
 LDCM0582  Fragment23 Ramos C60(0.72)  LDD2196  [19]
 LDCM0578  Fragment27 Ramos C60(0.59)  LDD2197  [19]
 LDCM0586  Fragment28 Ramos C60(0.58)  LDD2198  [19]
 LDCM0588  Fragment30 Ramos C60(0.66)  LDD2199  [19]
 LDCM0589  Fragment31 Ramos C60(0.82)  LDD2200  [19]
 LDCM0590  Fragment32 Ramos C60(0.69)  LDD2201  [19]
 LDCM0468  Fragment33 HCT 116 C463(0.77); C473(0.81); C722(0.81); C733(0.81)  LDD0785  [7]
 LDCM0596  Fragment38 Ramos C60(0.47)  LDD2203  [19]
 LDCM0427  Fragment51 HCT 116 C463(0.80); C473(0.80); C60(0.33); C722(0.77)  LDD0744  [7]
 LDCM0610  Fragment52 Ramos C60(0.60)  LDD2204  [19]
 LDCM0614  Fragment56 Ramos C60(0.53)  LDD2205  [19]
 LDCM0569  Fragment7 Ramos C60(1.06)  LDD2186  [19]
 LDCM0571  Fragment9 Ramos C60(0.93)  LDD2188  [19]
 LDCM0107  IAA HeLa C649(0.00); H265(0.00)  LDD0221  [11]
 LDCM0022  KB02 HCT 116 C463(3.74); C473(3.74)  LDD0080  [7]
 LDCM0023  KB03 HCT 116 C463(4.21); C473(4.21)  LDD0081  [7]
 LDCM0024  KB05 HCT 116 C463(5.28); C473(5.28)  LDD0082  [7]
 LDCM0509  N-(4-bromo-3,5-dimethylphenyl)-2-nitroacetamide MDA-MB-231 C649(1.28)  LDD2102  [5]
 LDCM0109  NEM HeLa N.A.  LDD0226  [11]
 LDCM0497  Nucleophilic fragment 11b MDA-MB-231 C649(1.28)  LDD2090  [5]
 LDCM0499  Nucleophilic fragment 12b MDA-MB-231 C649(1.11)  LDD2092  [5]
 LDCM0500  Nucleophilic fragment 13a MDA-MB-231 C649(1.48)  LDD2093  [5]
 LDCM0505  Nucleophilic fragment 15b MDA-MB-231 C649(0.98)  LDD2098  [5]
 LDCM0506  Nucleophilic fragment 16a MDA-MB-231 C649(1.12)  LDD2099  [5]
 LDCM0507  Nucleophilic fragment 16b MDA-MB-231 C649(1.17)  LDD2100  [5]
 LDCM0511  Nucleophilic fragment 18b MDA-MB-231 C649(0.71)  LDD2104  [5]
 LDCM0512  Nucleophilic fragment 19a MDA-MB-231 C649(0.98)  LDD2105  [5]
 LDCM0515  Nucleophilic fragment 20b MDA-MB-231 C649(1.08)  LDD2108  [5]
 LDCM0516  Nucleophilic fragment 21a MDA-MB-231 C649(0.73)  LDD2109  [5]
 LDCM0518  Nucleophilic fragment 22a MDA-MB-231 C649(1.24)  LDD2111  [5]
 LDCM0521  Nucleophilic fragment 23b MDA-MB-231 C649(0.67)  LDD2114  [5]
 LDCM0534  Nucleophilic fragment 30a MDA-MB-231 C649(0.95)  LDD2127  [5]
 LDCM0542  Nucleophilic fragment 37 MDA-MB-231 C649(1.41)  LDD2135  [5]
 LDCM0544  Nucleophilic fragment 39 MDA-MB-231 C649(1.01)  LDD2137  [5]
 LDCM0546  Nucleophilic fragment 40 MDA-MB-231 C649(0.90)  LDD2140  [5]
 LDCM0547  Nucleophilic fragment 41 MDA-MB-231 C649(0.67)  LDD2141  [5]
 LDCM0628  OTUB2-COV-1 HEK-293T C547(0.73)  LDD2207  [20]
 LDCM0090  Rapamycin JHH-7 2.03  LDD0213  [16]

The Interaction Atlas With This Target

The Protein(s) Related To This Target

Other
Click To Hide/Show 1 Protein(s) Interacting with This Target
Protein name Family Uniprot ID
Protein scribble homolog (SCRIB) LAP (LRR and PDZ) protein family Q14160

The Drug(s) Related To This Target

Approved
Click To Hide/Show 4 Drug(s) Interacting with This Target
Drug Name Drug Type External ID
Desflurane Small molecular drug DB01189
Halothane Small molecular drug DB01159
Ritodrine Small molecular drug DB00867
Sevoflurane Small molecular drug DB01236

References

1 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.
2 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
3 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.
4 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.
5 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
6 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.
7 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.
8 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
9 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
10 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
11 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.
12 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
13 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
14 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.
15 Design and synthesis of minimalist terminal alkyne-containing diazirine photo-crosslinkers and their incorporation into kinase inhibitors for cell- and tissue-based proteome profiling. Angew Chem Int Ed Engl. 2013 Aug 12;52(33):8551-6. doi: 10.1002/anie.201300683. Epub 2013 Jun 10.
16 Rapamycin targets STAT3 and impacts c-Myc to suppress tumor growth. Cell Chem Biol. 2022 Mar 17;29(3):373-385.e6. doi: 10.1016/j.chembiol.2021.10.006. Epub 2021 Oct 26.
17 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
18 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
19 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
20 Rapid Covalent-Probe Discovery by Electrophile-Fragment Screening. J Am Chem Soc. 2019 Jun 5;141(22):8951-8968. doi: 10.1021/jacs.9b02822. Epub 2019 May 22.