BDBM50404129 CHEMBL342806

SMILES: Clc1c(sc2ccccc12)C(=O)Nc1c(Cl)cccc1C(=O)Nc1ccc(Cl)cc1

InChI Key: InChIKey=UEDUPTHBCYCYHE-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50404129   

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
Coagulation factor X (Homo sapiens (Human))	BDBM50404129 (CHEMBL342806) Show SMILES Clc1c(sc2ccccc12)C(=O)Nc1c(Cl)cccc1C(=O)Nc1ccc(Cl)cc1 Show InChI InChI=1S/C22H13Cl3N2O2S/c23-12-8-10-13(11-9-12)26-21(28)15-5-3-6-16(24)19(15)27-22(29)20-18(25)14-4-1-2-7-17(14)30-20/h1-11H,(H,26,28)(H,27,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	24	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Berlex Biosciences Curated by ChEMBL					Assay Description Inhibition constant against human factor Xa				Bioorg Med Chem Lett 13: 507-11 (2003) BindingDB Entry DOI: 10.7270/Q21N829C
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50404129 (CHEMBL342806) Show SMILES Clc1c(sc2ccccc12)C(=O)Nc1c(Cl)cccc1C(=O)Nc1ccc(Cl)cc1 Show InChI InChI=1S/C22H13Cl3N2O2S/c23-12-8-10-13(11-9-12)26-21(28)15-5-3-6-16(24)19(15)27-22(29)20-18(25)14-4-1-2-7-17(14)30-20/h1-11H,(H,26,28)(H,27,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Berlex Biosciences Curated by ChEMBL					Assay Description Inhibition constant against human thrombin				Bioorg Med Chem Lett 13: 507-11 (2003) BindingDB Entry DOI: 10.7270/Q21N829C
					More data for this Ligand-Target Pair
Trypsin (Homo sapiens (Human))	BDBM50404129 (CHEMBL342806) Show SMILES Clc1c(sc2ccccc12)C(=O)Nc1c(Cl)cccc1C(=O)Nc1ccc(Cl)cc1 Show InChI InChI=1S/C22H13Cl3N2O2S/c23-12-8-10-13(11-9-12)26-21(28)15-5-3-6-16(24)19(15)27-22(29)20-18(25)14-4-1-2-7-17(14)30-20/h1-11H,(H,26,28)(H,27,29)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Berlex Biosciences Curated by ChEMBL					Assay Description Inhibition constant against bovine trypsin				Bioorg Med Chem Lett 13: 507-11 (2003) BindingDB Entry DOI: 10.7270/Q21N829C
					More data for this Ligand-Target Pair