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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrin alpha-V/beta-1' and Ligand = 'BDBM50141311'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Integrin alpha-V/beta-1


(Homo sapiens (Human))
BDBM50141311
PNG
(3-{4-[3-(4,5-Dihydro-1H-imidazol-2-ylamino)-benzoy...)
Show SMILES Cc1cc(C=CC(O)=O)cc(C)c1NC(=O)c1cccc(NC2=NCCN2)c1 |w:5.5,t:23|
Show InChI InChI=1S/C21H22N4O3/c1-13-10-15(6-7-18(26)27)11-14(2)19(13)25-20(28)16-4-3-5-17(12-16)24-21-22-8-9-23-21/h3-7,10-12H,8-9H2,1-2H3,(H,25,28)(H,26,27)(H2,22,23,24)
PDB

UniProtKB/SwissProt

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antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 264n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Binding affinity towards alpha V/beta3 receptor by solid-phase receptor binding assays (SPRA)


Bioorg Med Chem Lett 14: 1471-6 (2004)


Article DOI: 10.1016/j.bmcl.2004.01.015
BindingDB Entry DOI: 10.7270/Q2RJ4HXS
More data for this
Ligand-Target Pair