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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Integrin alpha-IIb/beta-3' and Ligand = 'BDBM50421431'   
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-IIb/beta-3


(Homo sapiens (Human))
BDBM50421431
PNG
(CHEMBL66386)
Show SMILES CCCCCCOC(\C=C\c1ccc(cc1)C(N)=N)C(C)(C)C(=O)N1CCC(CC(O)=O)CC1
Show InChI InChI=1S/C27H41N3O4/c1-4-5-6-7-18-34-23(13-10-20-8-11-22(12-9-20)25(28)29)27(2,3)26(33)30-16-14-21(15-17-30)19-24(31)32/h8-13,21,23H,4-7,14-19H2,1-3H3,(H3,28,29)(H,31,32)/b13-10+
PDB

KEGG

UniProtKB/SwissProt

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DrugBank
antibodypedia
antibodypedia
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 794n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of alphaV-beta3 mediated cell adhesion


Bioorg Med Chem Lett 10: 859-63 (2000)


BindingDB Entry DOI: 10.7270/Q2W95BFN
More data for this
Ligand-Target Pair