BDBM50060057 3-{2-(Naphthalene-2-sulfonylamino)-3-[4-(naphthalene-2-sulfonyl)-piperazin-1-yl]-3-oxo-propyl}-benzamidine::CHEMBL320937

SMILES: NC(=N)c1cccc(CC(NS(=O)(=O)c2ccc3ccccc3c2)C(=O)N2CCN(CC2)S(=O)(=O)c2ccc3ccccc3c2)c1

InChI Key: InChIKey=ORGILUVOCUNYPF-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50060057   

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
Thrombin (Bos taurus (Bovine))	BDBM50060057 (3-{2-(Naphthalene-2-sulfonylamino)-3-[4-(naphthale...) Show SMILES NC(=N)c1cccc(CC(NS(=O)(=O)c2ccc3ccccc3c2)C(=O)N2CCN(CC2)S(=O)(=O)c2ccc3ccccc3c2)c1 Show InChI InChI=1S/C34H33N5O5S2/c35-33(36)29-11-5-6-24(20-29)21-32(37-45(41,42)30-14-12-25-7-1-3-9-27(25)22-30)34(40)38-16-18-39(19-17-38)46(43,44)31-15-13-26-8-2-4-10-28(26)23-31/h1-15,20,22-23,32,37H,16-19,21H2,(H3,35,36)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	24	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Klinikum der Friedrich-Schiller-Universit£t Jena Curated by ChEMBL					Assay Description Inhibitory activity against thrombin				J Med Chem 40: 3091-9 (1997) Article DOI: 10.1021/jm960668h BindingDB Entry DOI: 10.7270/Q2Z60PRH
					More data for this Ligand-Target Pair
Trypsin II (Bos taurus)	BDBM50060057 (3-{2-(Naphthalene-2-sulfonylamino)-3-[4-(naphthale...) Show SMILES NC(=N)c1cccc(CC(NS(=O)(=O)c2ccc3ccccc3c2)C(=O)N2CCN(CC2)S(=O)(=O)c2ccc3ccccc3c2)c1 Show InChI InChI=1S/C34H33N5O5S2/c35-33(36)29-11-5-6-24(20-29)21-32(37-45(41,42)30-14-12-25-7-1-3-9-27(25)22-30)34(40)38-16-18-39(19-17-38)46(43,44)31-15-13-26-8-2-4-10-28(26)23-31/h1-15,20,22-23,32,37H,16-19,21H2,(H3,35,36)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	400	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Klinikum der Friedrich-Schiller-Universit£t Jena Curated by ChEMBL					Assay Description Inhibitory activity against trypsin				J Med Chem 40: 3091-9 (1997) Article DOI: 10.1021/jm960668h BindingDB Entry DOI: 10.7270/Q2Z60PRH
					More data for this Ligand-Target Pair
Plasminogen (Homo sapiens (Human))	BDBM50060057 (3-{2-(Naphthalene-2-sulfonylamino)-3-[4-(naphthale...) Show SMILES NC(=N)c1cccc(CC(NS(=O)(=O)c2ccc3ccccc3c2)C(=O)N2CCN(CC2)S(=O)(=O)c2ccc3ccccc3c2)c1 Show InChI InChI=1S/C34H33N5O5S2/c35-33(36)29-11-5-6-24(20-29)21-32(37-45(41,42)30-14-12-25-7-1-3-9-27(25)22-30)34(40)38-16-18-39(19-17-38)46(43,44)31-15-13-26-8-2-4-10-28(26)23-31/h1-15,20,22-23,32,37H,16-19,21H2,(H3,35,36)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Klinikum der Friedrich-Schiller-Universit£t Jena Curated by ChEMBL					Assay Description Inhibitory activity against plasmin				J Med Chem 40: 3091-9 (1997) Article DOI: 10.1021/jm960668h BindingDB Entry DOI: 10.7270/Q2Z60PRH
					More data for this Ligand-Target Pair
Coagulation factor X (Bos taurus)	BDBM50060057 (3-{2-(Naphthalene-2-sulfonylamino)-3-[4-(naphthale...) Show SMILES NC(=N)c1cccc(CC(NS(=O)(=O)c2ccc3ccccc3c2)C(=O)N2CCN(CC2)S(=O)(=O)c2ccc3ccccc3c2)c1 Show InChI InChI=1S/C34H33N5O5S2/c35-33(36)29-11-5-6-24(20-29)21-32(37-45(41,42)30-14-12-25-7-1-3-9-27(25)22-30)34(40)38-16-18-39(19-17-38)46(43,44)31-15-13-26-8-2-4-10-28(26)23-31/h1-15,20,22-23,32,37H,16-19,21H2,(H3,35,36)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Klinikum der Friedrich-Schiller-Universit£t Jena Curated by ChEMBL					Assay Description Inhibitory activity against coagulation factor X.				J Med Chem 40: 3091-9 (1997) Article DOI: 10.1021/jm960668h BindingDB Entry DOI: 10.7270/Q2Z60PRH
					More data for this Ligand-Target Pair