BDBM50065783 5-(2-{7-[2-(3,4-Dihydroxy-phenyl)-vinyl]-8-hydroxy-quinolin-2-yl}-vinyl)-2-hydroxy-benzoic acid::CHEMBL97641

SMILES: Oc1ccc(\C=C\c2ccc3ccc(\C=C\c4ccc(O)c(O)c4)c(O)c3n2)cc1O

InChI Key: InChIKey=WXABIPOGPDIRGT-ZSSQTCEHSA-N

Data: 3 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 3 hits for monomerid = 50065783   

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)	BDBM50065783 (5-(2-{7-[2-(3,4-Dihydroxy-phenyl)-vinyl]-8-hydroxy...) Show SMILES Oc1ccc(\C=C\c2ccc3ccc(\C=C\c4ccc(O)c(O)c4)c(O)c3n2)cc1O Show InChI InChI=1S/C25H19NO5/c27-20-11-3-15(13-22(20)29)1-5-18-7-6-17-8-10-19(26-24(17)25(18)31)9-2-16-4-12-21(28)23(30)14-16/h1-14,27-31H/b5-1+,9-2+	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris-Sud Curated by ChEMBL					Assay Description In vitro anti-HIV integrase activity of the compound was tested against integration(strand transfer) of target plasmid.				J Med Chem 41: 2846-57 (1998) Article DOI: 10.1021/jm980043e BindingDB Entry DOI: 10.7270/Q21Z43JH
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50065783 (5-(2-{7-[2-(3,4-Dihydroxy-phenyl)-vinyl]-8-hydroxy...) Show SMILES Oc1ccc(\C=C\c2ccc3ccc(\C=C\c4ccc(O)c(O)c4)c(O)c3n2)cc1O Show InChI InChI=1S/C25H19NO5/c27-20-11-3-15(13-22(20)29)1-5-18-7-6-17-8-10-19(26-24(17)25(18)31)9-2-16-4-12-21(28)23(30)14-16/h1-14,27-31H/b5-1+,9-2+	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.19E+3	n/a	n/a	n/a	n/a	n/a	n/a
Jadavpur University Curated by ChEMBL					Assay Description Inhibition of HIV1 integrase 3' processing activity				Eur J Med Chem 43: 81-92 (2008) Article DOI: 10.1016/j.ejmech.2007.02.021 BindingDB Entry DOI: 10.7270/Q24170XZ
					More data for this Ligand-Target Pair
Human immunodeficiency virus type 1 integrase (Human immunodeficiency virus 1)	BDBM50065783 (5-(2-{7-[2-(3,4-Dihydroxy-phenyl)-vinyl]-8-hydroxy...) Show SMILES Oc1ccc(\C=C\c2ccc3ccc(\C=C\c4ccc(O)c(O)c4)c(O)c3n2)cc1O Show InChI InChI=1S/C25H19NO5/c27-20-11-3-15(13-22(20)29)1-5-18-7-6-17-8-10-19(26-24(17)25(18)31)9-2-16-4-12-21(28)23(30)14-16/h1-14,27-31H/b5-1+,9-2+	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Université Paris-Sud Curated by ChEMBL					Assay Description HIV integrase inhibitory potency of the compound was evaluated as IC50 on 3' processing of target DNA.				J Med Chem 41: 2846-57 (1998) Article DOI: 10.1021/jm980043e BindingDB Entry DOI: 10.7270/Q21Z43JH
					More data for this Ligand-Target Pair