BDBM50422716 CHEMBL176023

SMILES: O=C(N1CCC(CC1)n1c(=O)c2c(c1=O)c(=O)c1[nH]cc[nH]c1c2=O)c1ccccc1

InChI Key: InChIKey=HOAOAOGXQJUUPF-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50422716   

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
Human immunodeficiency virus type 1 integrase (Human immunodeficiency virus 1)	BDBM50422716 (CHEMBL176023) Show SMILES O=C(N1CCC(CC1)n1c(=O)c2c(c1=O)c(=O)c1[nH]cc[nH]c1c2=O)c1ccccc1 Show InChI InChI=1S/C22H18N4O5/c27-18-14-15(19(28)17-16(18)23-8-9-24-17)22(31)26(21(14)30)13-6-10-25(11-7-13)20(29)12-4-2-1-3-5-12/h1-5,8-9,13,23-24H,6-7,10-11H2	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Tibotec BVBA Curated by ChEMBL					Assay Description Log of inhibitory concentration against human immunodeficiency virus type 1 integrase				J Med Chem 48: 1930-40 (2005) Article DOI: 10.1021/jm049559q BindingDB Entry DOI: 10.7270/Q29Z94FZ
					More data for this Ligand-Target Pair