BDBM50404114 CHEMBL146592

SMILES: Cc1nc(C)c(s1)C(=O)Nc1ccc(C)cc1C(=O)Nc1ccc(Cl)cc1

InChI Key: InChIKey=XBMDTXBEJOMCKZ-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 = 50404114   

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))	BDBM50404114 (CHEMBL146592) Show SMILES Cc1nc(C)c(s1)C(=O)Nc1ccc(C)cc1C(=O)Nc1ccc(Cl)cc1 Show InChI InChI=1S/C20H18ClN3O2S/c1-11-4-9-17(24-20(26)18-12(2)22-13(3)27-18)16(10-11)19(25)23-15-7-5-14(21)6-8-15/h4-10H,1-3H3,(H,23,25)(H,24,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	210	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
Trypsin (Homo sapiens (Human))	BDBM50404114 (CHEMBL146592) Show SMILES Cc1nc(C)c(s1)C(=O)Nc1ccc(C)cc1C(=O)Nc1ccc(Cl)cc1 Show InChI InChI=1S/C20H18ClN3O2S/c1-11-4-9-17(24-20(26)18-12(2)22-13(3)27-18)16(10-11)19(25)23-15-7-5-14(21)6-8-15/h4-10H,1-3H3,(H,23,25)(H,24,26)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	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
Prothrombin (Homo sapiens (Human))	BDBM50404114 (CHEMBL146592) Show SMILES Cc1nc(C)c(s1)C(=O)Nc1ccc(C)cc1C(=O)Nc1ccc(Cl)cc1 Show InChI InChI=1S/C20H18ClN3O2S/c1-11-4-9-17(24-20(26)18-12(2)22-13(3)27-18)16(10-11)19(25)23-15-7-5-14(21)6-8-15/h4-10H,1-3H3,(H,23,25)(H,24,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	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