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BDBM50269496 CHEMBL4090537

SMILES: COc1cc2c(Oc3ccc(NC(=O)c4nc5ccccc5n(-c5ccccc5F)c4=O)cc3F)ccnc2cc1OCCCN1CCC(C)CC1

InChI Key: InChIKey=IHLDUYHYMVUCMO-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50269496   
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
Hepatocyte growth factor receptor


(Homo sapiens (Human))		BDBM50269496
PNG
(CHEMBL4090537)
Show SMILES COc1cc2c(Oc3ccc(NC(=O)c4nc5ccccc5n(-c5ccccc5F)c4=O)cc3F)ccnc2cc1OCCCN1CCC(C)CC1 |(46.07,-12.24,;47.41,-11.47,;48.74,-12.24,;50.07,-11.47,;51.4,-12.24,;52.73,-11.46,;52.72,-9.92,;54.05,-9.15,;55.38,-9.91,;56.71,-9.14,;56.7,-7.6,;58.03,-6.82,;59.37,-7.58,;59.38,-9.12,;60.7,-6.8,;60.68,-5.26,;62.02,-4.49,;62.01,-2.96,;63.33,-2.18,;64.67,-2.95,;64.67,-4.48,;63.35,-5.25,;63.36,-6.79,;64.69,-7.55,;64.7,-9.09,;66.03,-9.86,;67.37,-9.08,;67.35,-7.53,;66.02,-6.78,;66,-5.24,;62.03,-7.57,;62.04,-9.11,;55.36,-6.83,;54.03,-7.61,;52.69,-6.86,;54.07,-12.22,;54.08,-13.77,;52.74,-14.55,;51.41,-13.78,;50.07,-14.56,;48.74,-13.79,;47.4,-14.56,;46.07,-13.78,;44.74,-14.55,;43.4,-13.78,;42.07,-14.55,;40.74,-13.78,;39.41,-14.54,;39.4,-16.08,;38.07,-16.85,;40.74,-16.86,;42.08,-16.09,)|
Show InChI InChI=1S/C40H37F2N5O5/c1-25-15-19-46(20-16-25)18-7-21-51-37-24-31-27(23-36(37)50-2)34(14-17-43-31)52-35-13-12-26(22-29(35)42)44-39(48)38-40(49)47(32-10-5-3-8-28(32)41)33-11-6-4-9-30(33)45-38/h3-6,8-14,17,22-25H,7,15-16,18-21H2,1-2H3,(H,44,48)
PDB
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KEGG

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 13n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University), Ministry of Education, 103 Wenhua Road, Shenhe District, Shenyang 110016, PR China; College of Pharma

Curated by ChEMBL


Assay Description
Inhibition of c-Met (unknown origin) using poly (Glu, Tyr) 4:1 as substrate after 30 mins by HTRF assay

Bioorg Med Chem 25: 4475-4486 (2017)


Article DOI: 10.1016/j.bmc.2017.06.037
BindingDB Entry DOI: 10.7270/Q2PC34W2
More data for this
Ligand-Target Pair