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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 = 'BDBM50059690'   
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))
BDBM50059690
PNG
(7-[(5-Carbamimidoyl-1-methyl-1H-indole-2-carbonyl)...)
Show SMILES Cn1c(cc2cc(ccc12)C(N)=N)C(=O)NCCCCCCC(O)=O
Show InChI InChI=1S/C18H24N4O3/c1-22-14-8-7-12(17(19)20)10-13(14)11-15(22)18(25)21-9-5-3-2-4-6-16(23)24/h7-8,10-11H,2-6,9H2,1H3,(H3,19,20)(H,21,25)(H,23,24)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 2.90E+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))
BDBM50059690
PNG
(7-[(5-Carbamimidoyl-1-methyl-1H-indole-2-carbonyl)...)
Show SMILES Cn1c(cc2cc(ccc12)C(N)=N)C(=O)NCCCCCCC(O)=O
Show InChI InChI=1S/C18H24N4O3/c1-22-14-8-7-12(17(19)20)10-13(14)11-15(22)18(25)21-9-5-3-2-4-6-16(23)24/h7-8,10-11H,2-6,9H2,1H3,(H3,19,20)(H,21,25)(H,23,24)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 7.50E+3n/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