BDBM50123033 1-(3-Amino-benzo[d]isoxazol-5-yl)-1H-tetrazole-5-carboxylic acid (3-fluoro-2'-sulfamoyl-biphenyl-4-yl)-amide::CHEMBL333270

SMILES: Nc1noc2ccc(cc12)-n1nnnc1C(=O)Nc1ccc(cc1F)-c1ccccc1S(N)(=O)=O

InChI Key: InChIKey=MJFTYSXBQUYFFQ-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 = 50123033   

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))	BDBM50123033 (1-(3-Amino-benzo[d]isoxazol-5-yl)-1H-tetrazole-5-c...) Show SMILES Nc1noc2ccc(cc12)-n1nnnc1C(=O)Nc1ccc(cc1F)-c1ccccc1S(N)(=O)=O Show InChI InChI=1S/C21H15FN8O4S/c22-15-9-11(13-3-1-2-4-18(13)35(24,32)33)5-7-16(15)25-21(31)20-26-28-29-30(20)12-6-8-17-14(10-12)19(23)27-34-17/h1-10H,(H2,23,27)(H,25,31)(H2,24,32,33)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.350	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibition of human purified factor Xa				Bioorg Med Chem Lett 13: 369-73 (2003) BindingDB Entry DOI: 10.7270/Q2BG2NC3
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50123033 (1-(3-Amino-benzo[d]isoxazol-5-yl)-1H-tetrazole-5-c...) Show SMILES Nc1noc2ccc(cc12)-n1nnnc1C(=O)Nc1ccc(cc1F)-c1ccccc1S(N)(=O)=O Show InChI InChI=1S/C21H15FN8O4S/c22-15-9-11(13-3-1-2-4-18(13)35(24,32)33)5-7-16(15)25-21(31)20-26-28-29-30(20)12-6-8-17-14(10-12)19(23)27-34-17/h1-10H,(H2,23,27)(H,25,31)(H2,24,32,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	600	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibitory constant against thrombin using human purified enzymes				Bioorg Med Chem Lett 13: 369-73 (2003) BindingDB Entry DOI: 10.7270/Q2BG2NC3
					More data for this Ligand-Target Pair
Trypsin-1 (Homo sapiens (Human))	BDBM50123033 (1-(3-Amino-benzo[d]isoxazol-5-yl)-1H-tetrazole-5-c...) Show SMILES Nc1noc2ccc(cc12)-n1nnnc1C(=O)Nc1ccc(cc1F)-c1ccccc1S(N)(=O)=O Show InChI InChI=1S/C21H15FN8O4S/c22-15-9-11(13-3-1-2-4-18(13)35(24,32)33)5-7-16(15)25-21(31)20-26-28-29-30(20)12-6-8-17-14(10-12)19(23)27-34-17/h1-10H,(H2,23,27)(H,25,31)(H2,24,32,33)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>5.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co. Curated by ChEMBL					Assay Description Inhibitory constant against trypsin using human purified enzymes				Bioorg Med Chem Lett 13: 369-73 (2003) BindingDB Entry DOI: 10.7270/Q2BG2NC3
					More data for this Ligand-Target Pair