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SMILES: Oc1nc(nc(C(=O)NCc2cccc(c2)-c2ccccc2)c1O)-c1cccs1

InChI Key: InChIKey=BLHIHZSLLMLLKQ-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50476516   

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
Integrase (Human immunodeficiency virus 1)	BDBM50476516 (CHEMBL232630) Show SMILES Oc1nc(nc(C(=O)NCc2cccc(c2)-c2ccccc2)c1O)-c1cccs1 Show InChI InChI=1S/C22H17N3O3S/c26-19-18(24-20(25-22(19)28)17-10-5-11-29-17)21(27)23-13-14-6-4-9-16(12-14)15-7-2-1-3-8-15/h1-12,26H,13H2,(H,23,27)(H,24,25,28)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
Universidade Estadual do Oeste do Paran£ Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				Eur J Med Chem 44: 3577-83 (2009) Article DOI: 10.1016/j.ejmech.2009.03.001 BindingDB Entry DOI: 10.7270/Q2348P7C
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50476516 (CHEMBL232630) Show SMILES Oc1nc(nc(C(=O)NCc2cccc(c2)-c2ccccc2)c1O)-c1cccs1 Show InChI InChI=1S/C22H17N3O3S/c26-19-18(24-20(25-22(19)28)17-10-5-11-29-17)21(27)23-13-14-6-4-9-16(12-14)15-7-2-1-3-8-15/h1-12,26H,13H2,(H,23,27)(H,24,25,28)	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
IRBM-MRL Rome Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase strand transfer activity				Bioorg Med Chem Lett 17: 350-3 (2007) Article DOI: 10.1016/j.bmcl.2006.10.054 BindingDB Entry DOI: 10.7270/Q2FN18ZF
					More data for this Ligand-Target Pair