null

SMILES: Cc1c2C(=O)N(CN3CCN(CC3)S(C)(=O)=O)C(=O)c2c(C)n1-c1ccccc1

InChI Key: InChIKey=KJOANMMLKQBFLO-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50522046   

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 2 (Homo sapiens (Human))	BDBM50522046 (CHEMBL4475138) Show SMILES Cc1c2C(=O)N(CN3CCN(CC3)S(C)(=O)=O)C(=O)c2c(C)n1-c1ccccc1 Show InChI InChI=1S/C20H24N4O4S/c1-14-17-18(15(2)24(14)16-7-5-4-6-8-16)20(26)23(19(17)25)13-21-9-11-22(12-10-21)29(3,27)28/h4-8H,9-13H2,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.38E+4	n/a	n/a	n/a	n/a	n/a	n/a
Wroclaw Medical University Curated by ChEMBL					Assay Description Inhibition of COX2 (unknown origin) assessed as suppression of PGG2 conversion to PGH2 incubated fro 2 mins by TMPD based colorimetric assay				Bioorg Med Chem 27: 3918-3928 (2019) Article DOI: 10.1016/j.bmc.2019.07.033 BindingDB Entry DOI: 10.7270/Q2B56P4S
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Homo sapiens (Human))	BDBM50522046 (CHEMBL4475138) Show SMILES Cc1c2C(=O)N(CN3CCN(CC3)S(C)(=O)=O)C(=O)c2c(C)n1-c1ccccc1 Show InChI InChI=1S/C20H24N4O4S/c1-14-17-18(15(2)24(14)16-7-5-4-6-8-16)20(26)23(19(17)25)13-21-9-11-22(12-10-21)29(3,27)28/h4-8H,9-13H2,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.42E+5	n/a	n/a	n/a	n/a	n/a	n/a
Wroclaw Medical University Curated by ChEMBL					Assay Description Inhibition of COX1 (unknown origin) assessed as suppression of PGG2 conversion to PGH2 incubated fro 2 mins by TMPD based colorimetric assay				Bioorg Med Chem 27: 3918-3928 (2019) Article DOI: 10.1016/j.bmc.2019.07.033 BindingDB Entry DOI: 10.7270/Q2B56P4S
					More data for this Ligand-Target Pair