null

SMILES: NC(=N)c1ccc(cc1)N1CCC2(CCN(CC2)C(=O)COCC(O)=O)C1=O

InChI Key: InChIKey=TWXBFWRQAKTFER-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50143852   

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))	BDBM50143852 (CHEMBL65525 | {2-[2-(4-Carbamimidoyl-phenyl)-1-oxo...) Show SMILES NC(=N)c1ccc(cc1)N1CCC2(CCN(CC2)C(=O)COCC(O)=O)C1=O Show InChI InChI=1S/C19H24N4O5/c20-17(21)13-1-3-14(4-2-13)23-10-7-19(18(23)27)5-8-22(9-6-19)15(24)11-28-12-16(25)26/h1-4H,5-12H2,(H3,20,21)(H,25,26)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	108	n/a	n/a	n/a	n/a	n/a	n/a
Millennium Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Inhibition of platelet aggregation induced by 20 microM adenosine 5-diphosphate (ADP) in citrated human platelet rich plasma (h-PRP)				J Med Chem 47: 2037-61 (2004) Article DOI: 10.1021/jm030354b BindingDB Entry DOI: 10.7270/Q2FQ9W1H
					More data for this Ligand-Target Pair
Integrin alpha-V/beta-3 (Homo sapiens (Human))	BDBM50143852 (CHEMBL65525 | {2-[2-(4-Carbamimidoyl-phenyl)-1-oxo...) Show SMILES NC(=N)c1ccc(cc1)N1CCC2(CCN(CC2)C(=O)COCC(O)=O)C1=O Show InChI InChI=1S/C19H24N4O5/c20-17(21)13-1-3-14(4-2-13)23-10-7-19(18(23)27)5-8-22(9-6-19)15(24)11-28-12-16(25)26/h1-4H,5-12H2,(H3,20,21)(H,25,26)	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Millennium Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Inhibition of vitronectin binding to Vitronectin receptor (alpha V beta 3)				J Med Chem 47: 2037-61 (2004) Article DOI: 10.1021/jm030354b BindingDB Entry DOI: 10.7270/Q2FQ9W1H
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Homo sapiens (Human))	BDBM50143852 (CHEMBL65525 | {2-[2-(4-Carbamimidoyl-phenyl)-1-oxo...) Show SMILES NC(=N)c1ccc(cc1)N1CCC2(CCN(CC2)C(=O)COCC(O)=O)C1=O Show InChI InChI=1S/C19H24N4O5/c20-17(21)13-1-3-14(4-2-13)23-10-7-19(18(23)27)5-8-22(9-6-19)15(24)11-28-12-16(25)26/h1-4H,5-12H2,(H3,20,21)(H,25,26)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Millennium Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Tested for inhibition of the binding of fibrinogen to purified human GPIIb-IIIa in a 96-well format (ELISA assay)				J Med Chem 47: 2037-61 (2004) Article DOI: 10.1021/jm030354b BindingDB Entry DOI: 10.7270/Q2FQ9W1H
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Homo sapiens (Human))	BDBM50143852 (CHEMBL65525 | {2-[2-(4-Carbamimidoyl-phenyl)-1-oxo...) Show SMILES NC(=N)c1ccc(cc1)N1CCC2(CCN(CC2)C(=O)COCC(O)=O)C1=O Show InChI InChI=1S/C19H24N4O5/c20-17(21)13-1-3-14(4-2-13)23-10-7-19(18(23)27)5-8-22(9-6-19)15(24)11-28-12-16(25)26/h1-4H,5-12H2,(H3,20,21)(H,25,26)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	393	n/a	n/a	n/a	n/a	n/a	n/a
Millennium Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Inhibition of citrated human platelet (h-PRP) aggregation induced by 4 ug/mL collagen				J Med Chem 47: 2037-61 (2004) Article DOI: 10.1021/jm030354b BindingDB Entry DOI: 10.7270/Q2FQ9W1H
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Homo sapiens (Human))	BDBM50143852 (CHEMBL65525 | {2-[2-(4-Carbamimidoyl-phenyl)-1-oxo...) Show SMILES NC(=N)c1ccc(cc1)N1CCC2(CCN(CC2)C(=O)COCC(O)=O)C1=O Show InChI InChI=1S/C19H24N4O5/c20-17(21)13-1-3-14(4-2-13)23-10-7-19(18(23)27)5-8-22(9-6-19)15(24)11-28-12-16(25)26/h1-4H,5-12H2,(H3,20,21)(H,25,26)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
Millennium Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Inhibition of human platelet (h-PRP) aggregation induced by 20 microM ADP with PPACK				J Med Chem 47: 2037-61 (2004) Article DOI: 10.1021/jm030354b BindingDB Entry DOI: 10.7270/Q2FQ9W1H
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Homo sapiens (Human))	BDBM50143852 (CHEMBL65525 | {2-[2-(4-Carbamimidoyl-phenyl)-1-oxo...) Show SMILES NC(=N)c1ccc(cc1)N1CCC2(CCN(CC2)C(=O)COCC(O)=O)C1=O Show InChI InChI=1S/C19H24N4O5/c20-17(21)13-1-3-14(4-2-13)23-10-7-19(18(23)27)5-8-22(9-6-19)15(24)11-28-12-16(25)26/h1-4H,5-12H2,(H3,20,21)(H,25,26)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	691	n/a	n/a	n/a	n/a	n/a	n/a
Millennium Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Inhibition of human platelet (h-PRP) aggregation induced by 5 microM TRAP6 with PPACK				J Med Chem 47: 2037-61 (2004) Article DOI: 10.1021/jm030354b BindingDB Entry DOI: 10.7270/Q2FQ9W1H
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Homo sapiens (Human))	BDBM50143852 (CHEMBL65525 | {2-[2-(4-Carbamimidoyl-phenyl)-1-oxo...) Show SMILES NC(=N)c1ccc(cc1)N1CCC2(CCN(CC2)C(=O)COCC(O)=O)C1=O Show InChI InChI=1S/C19H24N4O5/c20-17(21)13-1-3-14(4-2-13)23-10-7-19(18(23)27)5-8-22(9-6-19)15(24)11-28-12-16(25)26/h1-4H,5-12H2,(H3,20,21)(H,25,26)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	273	n/a	n/a	n/a	n/a	n/a	n/a
Millennium Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Inhibition of citrated human (h-PRP) platelet aggregation induced by 5 uM TRAP6				J Med Chem 47: 2037-61 (2004) Article DOI: 10.1021/jm030354b BindingDB Entry DOI: 10.7270/Q2FQ9W1H
					More data for this Ligand-Target Pair
Integrin alpha-IIb/beta-3 (Homo sapiens (Human))	BDBM50143852 (CHEMBL65525 | {2-[2-(4-Carbamimidoyl-phenyl)-1-oxo...) Show SMILES NC(=N)c1ccc(cc1)N1CCC2(CCN(CC2)C(=O)COCC(O)=O)C1=O Show InChI InChI=1S/C19H24N4O5/c20-17(21)13-1-3-14(4-2-13)23-10-7-19(18(23)27)5-8-22(9-6-19)15(24)11-28-12-16(25)26/h1-4H,5-12H2,(H3,20,21)(H,25,26)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	812	n/a	n/a	n/a	n/a	n/a	n/a
Millennium Pharmaceuticals Inc. Curated by ChEMBL					Assay Description Inhibition of human platelet (h-PRP) aggregation induced by 4 ug/mL collagen with PPACK				J Med Chem 47: 2037-61 (2004) Article DOI: 10.1021/jm030354b BindingDB Entry DOI: 10.7270/Q2FQ9W1H
					More data for this Ligand-Target Pair