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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Integrin alpha-IIb/beta-3' and Ligand = 'BDBM50059683'   
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))
BDBM50059683
PNG
(3-(4-{[(5-Carbamimidoyl-1H-indole-2-carbonyl)-amin...)
Show SMILES NC(=N)c1ccc2[nH]c(cc2c1)C(=O)NCc1ccc(CCC(O)=O)cc1
Show InChI InChI=1S/C20H20N4O3/c21-19(22)14-6-7-16-15(9-14)10-17(24-16)20(27)23-11-13-3-1-12(2-4-13)5-8-18(25)26/h1-4,6-7,9-10,24H,5,8,11H2,(H3,21,22)(H,23,27)(H,25,26)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.00E+3n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Antagonism of fibrinogen binding to a purified human fibrinogen receptor preparation.


J Med Chem 40: 2843-57 (1997)


Article DOI: 10.1021/jm970020k
BindingDB Entry DOI: 10.7270/Q24M93MS
More data for this
Ligand-Target Pair
Integrin alpha-IIb/beta-3


(Homo sapiens (Human))
BDBM50059683
PNG
(3-(4-{[(5-Carbamimidoyl-1H-indole-2-carbonyl)-amin...)
Show SMILES NC(=N)c1ccc2[nH]c(cc2c1)C(=O)NCc1ccc(CCC(O)=O)cc1
Show InChI InChI=1S/C20H20N4O3/c21-19(22)14-6-7-16-15(9-14)10-17(24-16)20(27)23-11-13-3-1-12(2-4-13)5-8-18(25)26/h1-4,6-7,9-10,24H,5,8,11H2,(H3,21,22)(H,23,27)(H,25,26)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.90E+4n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of the platelet GPIIb-IIIa receptor measured as ability to attenuate ADP-induced (fibrinogen-mediated) platelet aggregation in human plate...


J Med Chem 40: 2843-57 (1997)


Article DOI: 10.1021/jm970020k
BindingDB Entry DOI: 10.7270/Q24M93MS
More data for this
Ligand-Target Pair