BDBM50304620 2-(1-(3-(6-chloronaphthalen-2-ylsulfonyl)propanoyl)piperidin-4-yl)-5-(hydroxymethyl)-1H-imidazo[1,5-c]imidazol-3(2H)-one::2-(1-{3-[(6-Chloronaphthalene-2-yl)sulfonyl]propanoyl}-piperidin-4-yl)-5-(hydroxymethyl)-1,2-dihydro-3H-imidazo[1,5-c]imidazol-3-one::CHEMBL593482

SMILES: OCc1ncc2CN(C3CCN(CC3)C(=O)CCS(=O)(=O)c3ccc4cc(Cl)ccc4c3)C(=O)n12

InChI Key: InChIKey=PJHHHEVXZRKZJY-UHFFFAOYSA-N

Data: 3 KI  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 5 hits for monomerid = 50304620   

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
Prothrombin (Homo sapiens (Human))	BDBM50304620 (2-(1-(3-(6-chloronaphthalen-2-ylsulfonyl)propanoyl...) Show SMILES OCc1ncc2CN(C3CCN(CC3)C(=O)CCS(=O)(=O)c3ccc4cc(Cl)ccc4c3)C(=O)n12 Show InChI InChI=1S/C24H25ClN4O5S/c25-18-3-1-17-12-21(4-2-16(17)11-18)35(33,34)10-7-23(31)27-8-5-19(6-9-27)28-14-20-13-26-22(15-30)29(20)24(28)32/h1-4,11-13,19,30H,5-10,14-15H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.80E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Company, Ltd Curated by ChEMBL					Assay Description Inhibition of human thrombin by para-nitroanilide release assay				Bioorg Med Chem 17: 7993-8002 (2009) Article DOI: 10.1016/j.bmc.2009.10.009 BindingDB Entry DOI: 10.7270/Q2HX1DM0
					More data for this Ligand-Target Pair
Tissue-type plasminogen activator (Homo sapiens (Human))	BDBM50304620 (2-(1-(3-(6-chloronaphthalen-2-ylsulfonyl)propanoyl...) Show SMILES OCc1ncc2CN(C3CCN(CC3)C(=O)CCS(=O)(=O)c3ccc4cc(Cl)ccc4c3)C(=O)n12 Show InChI InChI=1S/C24H25ClN4O5S/c25-18-3-1-17-12-21(4-2-16(17)11-18)35(33,34)10-7-23(31)27-8-5-19(6-9-27)28-14-20-13-26-22(15-30)29(20)24(28)32/h1-4,11-13,19,30H,5-10,14-15H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>6.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Company, Ltd Curated by ChEMBL					Assay Description Inhibition of human tissue plasminogen activator by para-nitroanilide release assay				Bioorg Med Chem 17: 7993-8002 (2009) Article DOI: 10.1016/j.bmc.2009.10.009 BindingDB Entry DOI: 10.7270/Q2HX1DM0
					More data for this Ligand-Target Pair
Plasminogen (Homo sapiens (Human))	BDBM50304620 (2-(1-(3-(6-chloronaphthalen-2-ylsulfonyl)propanoyl...) Show SMILES OCc1ncc2CN(C3CCN(CC3)C(=O)CCS(=O)(=O)c3ccc4cc(Cl)ccc4c3)C(=O)n12 Show InChI InChI=1S/C24H25ClN4O5S/c25-18-3-1-17-12-21(4-2-16(17)11-18)35(33,34)10-7-23(31)27-8-5-19(6-9-27)28-14-20-13-26-22(15-30)29(20)24(28)32/h1-4,11-13,19,30H,5-10,14-15H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>6.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Company, Ltd Curated by ChEMBL					Assay Description Inhibition of human plasmin by para-nitroanilide release assay				Bioorg Med Chem 17: 7993-8002 (2009) Article DOI: 10.1016/j.bmc.2009.10.009 BindingDB Entry DOI: 10.7270/Q2HX1DM0
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50304620 (2-(1-(3-(6-chloronaphthalen-2-ylsulfonyl)propanoyl...) Show SMILES OCc1ncc2CN(C3CCN(CC3)C(=O)CCS(=O)(=O)c3ccc4cc(Cl)ccc4c3)C(=O)n12 Show InChI InChI=1S/C24H25ClN4O5S/c25-18-3-1-17-12-21(4-2-16(17)11-18)35(33,34)10-7-23(31)27-8-5-19(6-9-27)28-14-20-13-26-22(15-30)29(20)24(28)32/h1-4,11-13,19,30H,5-10,14-15H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Company, Ltd Curated by ChEMBL					Assay Description Inhibition of human factor 10a by para-nitroanilide release assay				Bioorg Med Chem 17: 7993-8002 (2009) Article DOI: 10.1016/j.bmc.2009.10.009 BindingDB Entry DOI: 10.7270/Q2HX1DM0
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50304620 (2-(1-(3-(6-chloronaphthalen-2-ylsulfonyl)propanoyl...) Show SMILES OCc1ncc2CN(C3CCN(CC3)C(=O)CCS(=O)(=O)c3ccc4cc(Cl)ccc4c3)C(=O)n12 Show InChI InChI=1S/C24H25ClN4O5S/c25-18-3-1-17-12-21(4-2-16(17)11-18)35(33,34)10-7-23(31)27-8-5-19(6-9-27)28-14-20-13-26-22(15-30)29(20)24(28)32/h1-4,11-13,19,30H,5-10,14-15H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
Takeda Pharmaceutical Company Ltd. Curated by ChEMBL					Assay Description Inhibition of human factor 10a assessed as p-nitroanilide release using S2765 as substrate by chromogenic assay				J Med Chem 53: 3517-31 (2010) Article DOI: 10.1021/jm901699j BindingDB Entry DOI: 10.7270/Q2PR7W52
					More data for this Ligand-Target Pair