BDBM50110009 3-Hydroxy-N-{[4-(N-hydroxycarbamimidoyl)-benzylcarbamoyl]-methyl}-2-phenylmethanesulfonylamino-propionamide::CHEMBL157479

SMILES: OC[C@@H](NS(=O)(=O)Cc1ccccc1)C(=O)NCC(=O)NCc1ccc(cc1)C(=N)NO

InChI Key: InChIKey=YVPCSDBGVOOVDK-QGZVFWFLSA-N

Data: 5 KI

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 5 hits for monomerid = 50110009   

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
Urokinase-type plasminogen activator (Homo sapiens (Human))	BDBM50110009 (3-Hydroxy-N-{[4-(N-hydroxycarbamimidoyl)-benzylcar...) Show SMILES OC[C@@H](NS(=O)(=O)Cc1ccccc1)C(=O)NCC(=O)NCc1ccc(cc1)C(=N)NO Show InChI InChI=1S/C20H25N5O6S/c21-19(24-29)16-8-6-14(7-9-16)10-22-18(27)11-23-20(28)17(12-26)25-32(30,31)13-15-4-2-1-3-5-15/h1-9,17,25-26,29H,10-13H2,(H2,21,24)(H,22,27)(H,23,28)/t17-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	6.10E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universitat Jena Curated by ChEMBL					Assay Description In vitro inhibition of plasminogen activator urokinase.				Bioorg Med Chem Lett 12: 645-8 (2002) BindingDB Entry DOI: 10.7270/Q2NZ86XS
					More data for this Ligand-Target Pair
Plasminogen (Homo sapiens (Human))	BDBM50110009 (3-Hydroxy-N-{[4-(N-hydroxycarbamimidoyl)-benzylcar...) Show SMILES OC[C@@H](NS(=O)(=O)Cc1ccccc1)C(=O)NCC(=O)NCc1ccc(cc1)C(=N)NO Show InChI InChI=1S/C20H25N5O6S/c21-19(24-29)16-8-6-14(7-9-16)10-22-18(27)11-23-20(28)17(12-26)25-32(30,31)13-15-4-2-1-3-5-15/h1-9,17,25-26,29H,10-13H2,(H2,21,24)(H,22,27)(H,23,28)/t17-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universitat Jena Curated by ChEMBL					Assay Description In vitro inhibition of Plasmin.				Bioorg Med Chem Lett 12: 645-8 (2002) BindingDB Entry DOI: 10.7270/Q2NZ86XS
					More data for this Ligand-Target Pair
Trypsin-1 (Homo sapiens (Human))	BDBM50110009 (3-Hydroxy-N-{[4-(N-hydroxycarbamimidoyl)-benzylcar...) Show SMILES OC[C@@H](NS(=O)(=O)Cc1ccccc1)C(=O)NCC(=O)NCc1ccc(cc1)C(=N)NO Show InChI InChI=1S/C20H25N5O6S/c21-19(24-29)16-8-6-14(7-9-16)10-22-18(27)11-23-20(28)17(12-26)25-32(30,31)13-15-4-2-1-3-5-15/h1-9,17,25-26,29H,10-13H2,(H2,21,24)(H,22,27)(H,23,28)/t17-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universitat Jena Curated by ChEMBL					Assay Description In vitro inhibition of trypsin.				Bioorg Med Chem Lett 12: 645-8 (2002) BindingDB Entry DOI: 10.7270/Q2NZ86XS
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50110009 (3-Hydroxy-N-{[4-(N-hydroxycarbamimidoyl)-benzylcar...) Show SMILES OC[C@@H](NS(=O)(=O)Cc1ccccc1)C(=O)NCC(=O)NCc1ccc(cc1)C(=N)NO Show InChI InChI=1S/C20H25N5O6S/c21-19(24-29)16-8-6-14(7-9-16)10-22-18(27)11-23-20(28)17(12-26)25-32(30,31)13-15-4-2-1-3-5-15/h1-9,17,25-26,29H,10-13H2,(H2,21,24)(H,22,27)(H,23,28)/t17-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universitat Jena Curated by ChEMBL					Assay Description In vitro inhibition of Coagulation factor Xa.				Bioorg Med Chem Lett 12: 645-8 (2002) BindingDB Entry DOI: 10.7270/Q2NZ86XS
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50110009 (3-Hydroxy-N-{[4-(N-hydroxycarbamimidoyl)-benzylcar...) Show SMILES OC[C@@H](NS(=O)(=O)Cc1ccccc1)C(=O)NCC(=O)NCc1ccc(cc1)C(=N)NO Show InChI InChI=1S/C20H25N5O6S/c21-19(24-29)16-8-6-14(7-9-16)10-22-18(27)11-23-20(28)17(12-26)25-32(30,31)13-15-4-2-1-3-5-15/h1-9,17,25-26,29H,10-13H2,(H2,21,24)(H,22,27)(H,23,28)/t17-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universitat Jena Curated by ChEMBL					Assay Description In vitro inhibition of thrombin.				Bioorg Med Chem Lett 12: 645-8 (2002) BindingDB Entry DOI: 10.7270/Q2NZ86XS
					More data for this Ligand-Target Pair