BDBM50235308 CHEMBL4089272

SMILES: CC1CCCN1c1ccc(CCNC(=O)c2nc3ccc(Cl)cc3c(O)c2C)cc1

InChI Key: InChIKey=ULGZDMBMOUGUKI-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 = 50235308   

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 (cyclooxygenase) (Ovis aries (Sheep))	BDBM50235308 (CHEMBL4089272) Show SMILES CC1CCCN1c1ccc(CCNC(=O)c2nc3ccc(Cl)cc3c(O)c2C)cc1 Show InChI InChI=1S/C24H26ClN3O2/c1-15-4-3-13-28(15)19-8-5-17(6-9-19)11-12-26-24(30)22-16(2)23(29)20-14-18(25)7-10-21(20)27-22/h5-10,14-15H,3-4,11-13H2,1-2H3,(H,26,30)(H,27,29)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Al-Azhar University Curated by ChEMBL					Assay Description Inhibitory activity was determined against bovine liver beta galactosidase				Eur J Med Chem 127: 972-985 (2017) Article DOI: 10.1016/j.ejmech.2016.11.006 BindingDB Entry DOI: 10.7270/Q2NC63G3
					More data for this Ligand-Target Pair
Prostaglandin E synthase/G/H synthase 2 (Homo sapiens (Human))	BDBM50235308 (CHEMBL4089272) Show SMILES CC1CCCN1c1ccc(CCNC(=O)c2nc3ccc(Cl)cc3c(O)c2C)cc1 Show InChI InChI=1S/C24H26ClN3O2/c1-15-4-3-13-28(15)19-8-5-17(6-9-19)11-12-26-24(30)22-16(2)23(29)20-14-18(25)7-10-21(20)27-22/h5-10,14-15H,3-4,11-13H2,1-2H3,(H,26,30)(H,27,29)	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	1.91E+3	n/a	n/a	n/a	n/a	n/a	n/a
Al-Azhar University Curated by ChEMBL					Assay Description Inhibition of recombinant human COX2 using arachidonic acid as substrate assessed as decrease in PGF2 production preincubated for 15 mins followed by...				Eur J Med Chem 127: 972-985 (2017) Article DOI: 10.1016/j.ejmech.2016.11.006 BindingDB Entry DOI: 10.7270/Q2NC63G3
					More data for this Ligand-Target Pair