Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Integrin alpha-IIb/beta-3' and Ligand = 'BDBM50006297'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Integrin alpha-IIb/beta-3 (Homo sapiens (Human))	BDBM50006297 (15-Carbamoylmethyl-6-carboxymethyl-12-(3-guanidino...) Show SMILES NC(=O)C[C@@H]1NC(=O)CSC[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)CNC(=O)[C@H](CCCNC(N)=N)NC1=O)C(O)=O Show InChI InChI=1S/C21H33N9O10S/c22-13(31)4-10-18(37)29-9(2-1-3-25-21(23)24)17(36)26-6-14(32)27-11(5-16(34)35)19(38)30-12(20(39)40)7-41-8-15(33)28-10/h9-12H,1-8H2,(H2,22,31)(H,26,36)(H,27,32)(H,28,33)(H,29,37)(H,30,38)(H,34,35)(H,39,40)(H4,23,24,25)/t9-,10-,11-,12-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.70	n/a	n/a	n/a	n/a	n/a	n/a
Genentech Curated by ChEMBL					Assay Description Inhibition of ADP-induced platelet aggregation in human platelet-rich plasma				J Med Chem 35: 2040-8 (1992) BindingDB Entry DOI: 10.7270/Q2S1833Q
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Homo sapiens (Human))	BDBM50006297 (15-Carbamoylmethyl-6-carboxymethyl-12-(3-guanidino...) Show SMILES NC(=O)C[C@@H]1NC(=O)CSC[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)CNC(=O)[C@H](CCCNC(N)=N)NC1=O)C(O)=O Show InChI InChI=1S/C21H33N9O10S/c22-13(31)4-10-18(37)29-9(2-1-3-25-21(23)24)17(36)26-6-14(32)27-11(5-16(34)35)19(38)30-12(20(39)40)7-41-8-15(33)28-10/h9-12H,1-8H2,(H2,22,31)(H,26,36)(H,27,32)(H,28,33)(H,29,37)(H,30,38)(H,34,35)(H,39,40)(H4,23,24,25)/t9-,10-,11-,12-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
Genentech Curated by ChEMBL					Assay Description Inhibition of ADP-induced platelet aggregation in human platelet-rich plasma				J Med Chem 35: 2040-8 (1992) BindingDB Entry DOI: 10.7270/Q2S1833Q
					More data for this Ligand-Target Pair