BDBM50124787 2-(5-Methoxy-1H-benzoimidazol-2-ylsulfanylmethyl)-3-pentadecyl-phenol::CHEMBL347705

SMILES: CCCCCCCCCCCCCCCc1cccc(O)c1CSc1nc2ccc(OC)cc2[nH]1

InChI Key: InChIKey=UVLGLYJPLOSDFD-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50124787   

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
Prostaglandin G/H synthase 1 (Homo sapiens (Human))	BDBM50124787 (2-(5-Methoxy-1H-benzoimidazol-2-ylsulfanylmethyl)-...) Show SMILES CCCCCCCCCCCCCCCc1cccc(O)c1CSc1nc2ccc(OC)cc2[nH]1 Show InChI InChI=1S/C30H44N2O2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-17-24-18-16-19-29(33)26(24)23-35-30-31-27-21-20-25(34-2)22-28(27)32-30/h16,18-22,33H,3-15,17,23H2,1-2H3,(H,31,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.84E+5	n/a	n/a	n/a	n/a	n/a	n/a
Vittal Mallya Scientific Research Foundation Curated by ChEMBL					Assay Description Inhibitory activity against Prostaglandin G/H synthase 1 in human whole blood assay as TXB2 generation				Bioorg Med Chem Lett 13: 657-60 (2003) BindingDB Entry DOI: 10.7270/Q2QF8S8R
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Homo sapiens (Human))	BDBM50124787 (2-(5-Methoxy-1H-benzoimidazol-2-ylsulfanylmethyl)-...) Show SMILES CCCCCCCCCCCCCCCc1cccc(O)c1CSc1nc2ccc(OC)cc2[nH]1 Show InChI InChI=1S/C30H44N2O2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-17-24-18-16-19-29(33)26(24)23-35-30-31-27-21-20-25(34-2)22-28(27)32-30/h16,18-22,33H,3-15,17,23H2,1-2H3,(H,31,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
ASBASJSM College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of human COX2				Eur J Med Chem 76: 494-505 (2014) Article DOI: 10.1016/j.ejmech.2014.01.030 BindingDB Entry DOI: 10.7270/Q24B3494
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Homo sapiens (Human))	BDBM50124787 (2-(5-Methoxy-1H-benzoimidazol-2-ylsulfanylmethyl)-...) Show SMILES CCCCCCCCCCCCCCCc1cccc(O)c1CSc1nc2ccc(OC)cc2[nH]1 Show InChI InChI=1S/C30H44N2O2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-17-24-18-16-19-29(33)26(24)23-35-30-31-27-21-20-25(34-2)22-28(27)32-30/h16,18-22,33H,3-15,17,23H2,1-2H3,(H,31,32)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.84E+5	n/a	n/a	n/a	n/a	n/a	n/a
ASBASJSM College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of human COX1				Eur J Med Chem 76: 494-505 (2014) Article DOI: 10.1016/j.ejmech.2014.01.030 BindingDB Entry DOI: 10.7270/Q24B3494
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Homo sapiens (Human))	BDBM50124787 (2-(5-Methoxy-1H-benzoimidazol-2-ylsulfanylmethyl)-...) Show SMILES CCCCCCCCCCCCCCCc1cccc(O)c1CSc1nc2ccc(OC)cc2[nH]1 Show InChI InChI=1S/C30H44N2O2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-17-24-18-16-19-29(33)26(24)23-35-30-31-27-21-20-25(34-2)22-28(27)32-30/h16,18-22,33H,3-15,17,23H2,1-2H3,(H,31,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Vittal Mallya Scientific Research Foundation Curated by ChEMBL					Assay Description Inhibitory activity against Prostaglandin G/H synthase 2 in human whole blood assay as LPS induced PGE-2 generation.				Bioorg Med Chem Lett 13: 657-60 (2003) BindingDB Entry DOI: 10.7270/Q2QF8S8R
					More data for this Ligand-Target Pair