BDBM49181 5-(4-Benzyl-piperazin-1-ylmethyl)-quinolin-8-ol::5-[(4-benzylpiperazin-1-yl)methyl]quinolin-8-ol::5-[(4-benzylpiperazino)methyl]quinolin-8-ol::5-[[4-(phenylmethyl)-1-piperazinyl]methyl]-8-quinolinol::5-[[4-(phenylmethyl)piperazin-1-yl]methyl]quinolin-8-ol::MLS000075465::SMR000014637::cid_651866

SMILES: Oc1ccc(CN2CCN(Cc3ccccc3)CC2)c2cccnc12

InChI Key: InChIKey=KVSFNSYWZHJDIE-UHFFFAOYSA-N

Data: 3 IC50  2 EC50

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 5 hits for monomerid = 49181   

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
Nuclear factor NF-kappa-B (Homo sapiens (Human))	BDBM49181 (5-(4-Benzyl-piperazin-1-ylmethyl)-quinolin-8-ol | ...) Show SMILES Oc1ccc(CN2CCN(Cc3ccccc3)CC2)c2cccnc12 Show InChI InChI=1S/C21H23N3O/c25-20-9-8-18(19-7-4-10-22-21(19)20)16-24-13-11-23(12-14-24)15-17-5-2-1-3-6-17/h1-10,25H,11-16H2	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents Similars	PCBioAssay	n/a	n/a	n/a	n/a	5.24E+3	n/a	n/a	n/a	n/a
SRMLSC Curated by PubChem BioAssay					Assay Description Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q27P8WT7
					More data for this Ligand-Target Pair
heat shock protein 90 (Candida albicans)	BDBM49181 (5-(4-Benzyl-piperazin-1-ylmethyl)-quinolin-8-ol | ...) Show SMILES Oc1ccc(CN2CCN(Cc3ccccc3)CC2)c2cccnc12 Show InChI InChI=1S/C21H23N3O/c25-20-9-8-18(19-7-4-10-22-21(19)20)16-24-13-11-23(12-14-24)15-17-5-2-1-3-6-17/h1-10,25H,11-16H2	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents Similars	PCBioAssay	n/a	n/a	n/a	n/a	>1.60E+5	n/a	n/a	n/a	n/a
Broad Institute Curated by PubChem BioAssay					Assay Description Broad Institute: Reversing Antifungal Drug Resistance Project ID: 2037 Keywords: Candida albicans, drug resistance, Fluconazole, Hsp90, Calcineurin, ...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q26M358G
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM49181 (5-(4-Benzyl-piperazin-1-ylmethyl)-quinolin-8-ol | ...) Show SMILES Oc1ccc(CN2CCN(Cc3ccccc3)CC2)c2cccnc12 Show InChI InChI=1S/C21H23N3O/c25-20-9-8-18(19-7-4-10-22-21(19)20)16-24-13-11-23(12-14-24)15-17-5-2-1-3-6-17/h1-10,25H,11-16H2	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV-1 integrase 3'-processing activity				J Med Chem 56: 2311-22 (2013) Article DOI: 10.1021/jm301632e BindingDB Entry DOI: 10.7270/Q2348P98
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM49181 (5-(4-Benzyl-piperazin-1-ylmethyl)-quinolin-8-ol | ...) Show SMILES Oc1ccc(CN2CCN(Cc3ccccc3)CC2)c2cccnc12 Show InChI InChI=1S/C21H23N3O/c25-20-9-8-18(19-7-4-10-22-21(19)20)16-24-13-11-23(12-14-24)15-17-5-2-1-3-6-17/h1-10,25H,11-16H2	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of HIV-1 integrase strand transfer activity				J Med Chem 56: 2311-22 (2013) Article DOI: 10.1021/jm301632e BindingDB Entry DOI: 10.7270/Q2348P98
					More data for this Ligand-Target Pair
ubiquitin-conjugating enzyme E2 N (Homo sapiens (Human))	BDBM49181 (5-(4-Benzyl-piperazin-1-ylmethyl)-quinolin-8-ol | ...) Show SMILES Oc1ccc(CN2CCN(Cc3ccccc3)CC2)c2cccnc12 Show InChI InChI=1S/C21H23N3O/c25-20-9-8-18(19-7-4-10-22-21(19)20)16-24-13-11-23(12-14-24)15-17-5-2-1-3-6-17/h1-10,25H,11-16H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents Similars	PCBioAssay	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2X34VX0
					More data for this Ligand-Target Pair