BDBM50235316 CHEMBL4104705

SMILES: Cc1c(O)c2cc(Cl)ccc2nc1C(=O)N1CCCCC1

InChI Key: InChIKey=UPMBXOHLGCIFLZ-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 = 50235316   

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 E synthase/G/H synthase 2 (Homo sapiens (Human))	BDBM50235316 (CHEMBL4104705) Show SMILES Cc1c(O)c2cc(Cl)ccc2nc1C(=O)N1CCCCC1 Show InChI InChI=1S/C16H17ClN2O2/c1-10-14(16(21)19-7-3-2-4-8-19)18-13-6-5-11(17)9-12(13)15(10)20/h5-6,9H,2-4,7-8H2,1H3,(H,18,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	3.14E+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
Prostaglandin G/H synthase (cyclooxygenase) (Ovis aries (Sheep))	BDBM50235316 (CHEMBL4104705) Show SMILES Cc1c(O)c2cc(Cl)ccc2nc1C(=O)N1CCCCC1 Show InChI InChI=1S/C16H17ClN2O2/c1-10-14(16(21)19-7-3-2-4-8-19)18-13-6-5-11(17)9-12(13)15(10)20/h5-6,9H,2-4,7-8H2,1H3,(H,18,20)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	1.24E+4	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 Escherichia coli Alpha-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