BindingDB PrimarySearch

BDBM76305 5-chloranylquinolin-8-ol::5-chloro-8-quinolinol::5-chloroquinolin-8-ol::MLS002695956::SMR000274338::cid_2817

SMILES: Oc1ccc(Cl)c2cccnc12

InChI Key: InChIKey=CTQMJYWDVABFRZ-UHFFFAOYSA-N

Data: 10 IC50 1 EC50

PDB links: 2 PDB IDs match this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 11 hits for monomerid = 76305
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Methionine aminopeptidase 2 (Homo sapiens (Human))	BDBM76305 (5-chloranylquinolin-8-ol \| 5-chloro-8-quinolinol \|...) Show SMILES Oc1ccc(Cl)c2cccnc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	1.27E+3	n/a	n/a	n/a	n/a	n/a	n/a
Northern Illinois University Curated by ChEMBL					Assay Description Inhibition of human methionine aminopeptidase 2				ACS Med Chem Lett 4: (2013) Article DOI: 10.1021/ml400034m BindingDB Entry DOI: 10.7270/Q2XW4M72
Northern Illinois University Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)
Methionine Aminopeptidase Type 1 (MetAP1) (Homo sapiens (Human))	BDBM76305 (5-chloranylquinolin-8-ol \| 5-chloro-8-quinolinol \|...) Show SMILES Oc1ccc(Cl)c2cccnc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	1.29E+4	n/a	n/a	n/a	n/a	n/a	n/a
Northern Illinois University Curated by ChEMBL					Assay Description Inhibition of human methionine aminopeptidase 1				ACS Med Chem Lett 4: (2013) Article DOI: 10.1021/ml400034m BindingDB Entry DOI: 10.7270/Q2XW4M72
Northern Illinois University Curated by ChEMBL					More data for this Ligand-Target Pair
LAP4 (Saccharomyces cerevisiae)	BDBM76305 (5-chloranylquinolin-8-ol \| 5-chloro-8-quinolinol \|...) Show SMILES Oc1ccc(Cl)c2cccnc12 Show InChI	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	2.08E+5	n/a	n/a	n/a	n/a
NMMLSC Curated by PubChem BioAssay					Assay Description University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2057DDB
NMMLSC Curated by PubChem BioAssay					More data for this Ligand-Target Pair
Beta-galactosidase (Escherichia coli)	BDBM76305 (5-chloranylquinolin-8-ol \| 5-chloro-8-quinolinol \|...) Show SMILES Oc1ccc(Cl)c2cccnc12 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem Similars	PCBioAssay	n/a	n/a	>6.66E+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, C...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2NG4P4X
					More data for this Ligand-Target Pair
C-C chemokine receptor type 6 (CCR6) (Homo sapiens (Human))	BDBM76305 (5-chloranylquinolin-8-ol \| 5-chloro-8-quinolinol \|...) Show SMILES Oc1ccc(Cl)c2cccnc12 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem Similars	PCBioAssay	n/a	n/a	>6.66E+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/Q20P0XHD
					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM76305 (5-chloranylquinolin-8-ol \| 5-chloro-8-quinolinol \|...) Show SMILES Oc1ccc(Cl)c2cccnc12 Show InChI	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem 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
University of Southern California Curated by ChEMBL					More data for this Ligand-Target Pair
Methionine aminopeptidase 2 (Homo sapiens (Human))	BDBM76305 (5-chloranylquinolin-8-ol \| 5-chloro-8-quinolinol \|...) Show SMILES Oc1ccc(Cl)c2cccnc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	55	n/a	n/a	n/a	n/a	n/a	n/a
Northern Illinois University Curated by ChEMBL					Assay Description Inhibition of recombinant full length human N-terminal GST/His6-tagged methionine aminopeptidase 2 expressed in baculovirus infected sf9 cells using ...				Bioorg Med Chem 25: 813-824 (2017) Article DOI: 10.1016/j.bmc.2016.11.013 BindingDB Entry DOI: 10.7270/Q2125VV2
Northern Illinois University Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)
Botulinum neurotoxin type A (Clostridium botulinum)	BDBM76305 (5-chloranylquinolin-8-ol \| 5-chloro-8-quinolinol \|...) Show SMILES Oc1ccc(Cl)c2cccnc12 Show InChI	PDB MMDB NCI pathway Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem Similars	PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
U.S. Army Medical Research Institute of Infectious Diseases Curated by ChEMBL					Assay Description Inhibition of protease activity of recombinant full length Clostridium botulinum Hall BoNT/A light chain using SNAP-25 peptide (187 to 203 residues) ...				Bioorg Med Chem Lett 27: 675-678 (2017) BindingDB Entry DOI: 10.7270/Q2NP26PM
					More data for this Ligand-Target Pair
Bile salt export pump (Homo sapiens (Human))	BDBM76305 (5-chloranylquinolin-8-ol \| 5-chloro-8-quinolinol \|...) Show SMILES Oc1ccc(Cl)c2cccnc12 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	3.57E+5	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of human BSEP expressed in baculovirus transfected fall armyworm Sf21 cell membranes vesicles assessed as reduction in ATP-dependent [3H]-...				Drug Metab Dispos 40: 2332-41 (2012) Article DOI: 10.1124/dmd.112.047068 BindingDB Entry DOI: 10.7270/Q2ZP488M
AstraZeneca Curated by ChEMBL					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM76305 (5-chloranylquinolin-8-ol \| 5-chloro-8-quinolinol \|...) Show SMILES Oc1ccc(Cl)c2cccnc12 Show InChI	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem 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
University of Southern California Curated by ChEMBL					More data for this Ligand-Target Pair
Methionine Aminopeptidase Type 1 (MetAP1) (Homo sapiens (Human))	BDBM76305 (5-chloranylquinolin-8-ol \| 5-chloro-8-quinolinol \|...) Show SMILES Oc1ccc(Cl)c2cccnc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	>1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Northern Illinois University Curated by ChEMBL					Assay Description Inhibition of recombinant full length human His-tagged methionine aminopeptidase 1 expressed in Escherichia coli BL21(DE3) using methionylprolyl-p-ni...				Bioorg Med Chem 25: 813-824 (2017) Article DOI: 10.1016/j.bmc.2016.11.013 BindingDB Entry DOI: 10.7270/Q2125VV2
Northern Illinois University Curated by ChEMBL					More data for this Ligand-Target Pair