BDBM50061845 3-{3-[(5-Carbamimidoyl-benzofuran-2-carbonyl)-amino]-propionylamino}-3-(3,4-dimethoxy-phenyl)-propionic acid::CHEMBL137079

SMILES: COc1ccc(cc1OC)C(CC(O)=O)NC(=O)CCNC(=O)c1cc2cc(ccc2o1)C(N)=N

InChI Key: InChIKey=UPXTXJXYROSJCC-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50061845   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM50061845 (3-{3-[(5-Carbamimidoyl-benzofuran-2-carbonyl)-amin...) Show SMILES COc1ccc(cc1OC)C(CC(O)=O)NC(=O)CCNC(=O)c1cc2cc(ccc2o1)C(N)=N Show InChI InChI=1S/C24H26N4O7/c1-33-18-6-3-13(10-19(18)34-2)16(12-22(30)31)28-21(29)7-8-27-24(32)20-11-15-9-14(23(25)26)4-5-17(15)35-20/h3-6,9-11,16H,7-8,12H2,1-2H3,(H3,25,26)(H,27,32)(H,28,29)(H,30,31)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
COR Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibition of platelet aggregation induced by 20 microM adenosine 5'-diphosphate (ADP) in human platelet rich plasma (h-PRP).				J Med Chem 40: 4308-18 (1998) Article DOI: 10.1021/jm9704863 BindingDB Entry DOI: 10.7270/Q2HM57KW
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Homo sapiens (Human))	BDBM50061845 (3-{3-[(5-Carbamimidoyl-benzofuran-2-carbonyl)-amin...) Show SMILES COc1ccc(cc1OC)C(CC(O)=O)NC(=O)CCNC(=O)c1cc2cc(ccc2o1)C(N)=N Show InChI InChI=1S/C24H26N4O7/c1-33-18-6-3-13(10-19(18)34-2)16(12-22(30)31)28-21(29)7-8-27-24(32)20-11-15-9-14(23(25)26)4-5-17(15)35-20/h3-6,9-11,16H,7-8,12H2,1-2H3,(H3,25,26)(H,27,32)(H,28,29)(H,30,31)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
COR Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibitory activity of fibrinogen binding to purified immobilized glycoprotein (fibrinogen receptor).				J Med Chem 40: 4308-18 (1998) Article DOI: 10.1021/jm9704863 BindingDB Entry DOI: 10.7270/Q2HM57KW
					More data for this Ligand-Target Pair