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BDBM50301620 CHEMBL572095::benzyl 2-(1-(4-(1H-benzo[d]imidazol-1-yl)pyrimidin-2-ylamino)ethyl)-4-(naphthalen-1-ylcarbamoyl)piperazine-1-carboxylate

SMILES: CC(Nc1nccc(n1)-n1cnc2ccccc12)C1CN(CCN1C(=O)OCc1ccccc1)C(=O)Nc1cccc2ccccc12

InChI Key: InChIKey=GLMGQTWNDCMBGO-UHFFFAOYNA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50301620   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50301620
PNG
(CHEMBL572095 | benzyl 2-(1-(4-(1H-benzo[d]imidazol...)
Show SMILES CC(Nc1nccc(n1)-n1cnc2ccccc12)C1CN(CCN1C(=O)OCc1ccccc1)C(=O)Nc1cccc2ccccc12
Show InChI InChI=1/C36H34N8O3/c1-25(39-34-37-19-18-33(41-34)44-24-38-30-15-7-8-17-31(30)44)32-22-42(20-21-43(32)36(46)47-23-26-10-3-2-4-11-26)35(45)40-29-16-9-13-27-12-5-6-14-28(27)29/h2-19,24-25,32H,20-23H2,1H3,(H,40,45)(H,37,39,41)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Lck


Bioorg Med Chem Lett 19: 5440-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.102
BindingDB Entry DOI: 10.7270/Q2GX4BM0
More data for this
Ligand-Target Pair