BDBM50209895 CHEMBL244221::N-({7-[amino(imino)methyl]-2-naphthyl}methyl)-N-{1-[(2,5-dimethoxyphenyl)sulfonyl]piperidin-4-yl}acetamide

SMILES: COc1ccc(OC)c(c1)S(=O)(=O)N1CCC(CC1)N(Cc1ccc2ccc(cc2c1)C(N)=N)C(C)=O

InChI Key: InChIKey=QWLVBZMTHXDFED-UHFFFAOYSA-N

Data: 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 2 hits for monomerid = 50209895   

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))	BDBM50209895 (CHEMBL244221 | N-({7-[amino(imino)methyl]-2-naphth...) Show SMILES COc1ccc(OC)c(c1)S(=O)(=O)N1CCC(CC1)N(Cc1ccc2ccc(cc2c1)C(N)=N)C(C)=O Show InChI InChI=1S/C27H32N4O5S/c1-18(32)31(17-19-4-5-20-6-7-21(27(28)29)15-22(20)14-19)23-10-12-30(13-11-23)37(33,34)26-16-24(35-2)8-9-25(26)36-3/h4-9,14-16,23H,10-13,17H2,1-3H3,(H3,28,29)	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	12	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem 15: 4175-92 (2007) Article DOI: 10.1016/j.bmc.2007.03.066 BindingDB Entry DOI: 10.7270/Q27H1J90
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50209895 (CHEMBL244221 | N-({7-[amino(imino)methyl]-2-naphth...) Show SMILES COc1ccc(OC)c(c1)S(=O)(=O)N1CCC(CC1)N(Cc1ccc2ccc(cc2c1)C(N)=N)C(C)=O Show InChI InChI=1S/C27H32N4O5S/c1-18(32)31(17-19-4-5-20-6-7-21(27(28)29)15-22(20)14-19)23-10-12-30(13-11-23)37(33,34)26-16-24(35-2)8-9-25(26)36-3/h4-9,14-16,23H,10-13,17H2,1-3H3,(H3,28,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Astellas Pharma Inc. Curated by ChEMBL					Assay Description Inhibition of human thrombin				Bioorg Med Chem 15: 4175-92 (2007) Article DOI: 10.1016/j.bmc.2007.03.066 BindingDB Entry DOI: 10.7270/Q27H1J90
					More data for this Ligand-Target Pair