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BDBM50097085 2-(4-Bromo-phenyl)-6-sulfo-quinoline-4-carboxylic acid::CHEMBL153066

SMILES: OC(=O)c1cc(nc2ccc(cc12)S(O)(=O)=O)-c1ccc(Br)cc1

InChI Key: InChIKey=UBLBOXFCHGYNRT-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50097085   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Prolyl-tRNA synthetase


(Candida albicans)
BDBM50097085
PNG
(2-(4-Bromo-phenyl)-6-sulfo-quinoline-4-carboxylic ...)
Show SMILES OC(=O)c1cc(nc2ccc(cc12)S(O)(=O)=O)-c1ccc(Br)cc1
Show InChI InChI=1S/C16H10BrNO5S/c17-10-3-1-9(2-4-10)15-8-13(16(19)20)12-7-11(24(21,22)23)5-6-14(12)18-15/h1-8H,(H,19,20)(H,21,22,23)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 1.50E+4n/an/an/an/an/an/a



Cubist Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Aminoacylation activity against Candida albicans prolyl-tRNA synthetase


Bioorg Med Chem Lett 11: 541-4 (2001)


BindingDB Entry DOI: 10.7270/Q2Q23ZH8
More data for this
Ligand-Target Pair
Aminoacyl-tRNA synthetase


(Homo sapiens (Human))
BDBM50097085
PNG
(2-(4-Bromo-phenyl)-6-sulfo-quinoline-4-carboxylic ...)
Show SMILES OC(=O)c1cc(nc2ccc(cc12)S(O)(=O)=O)-c1ccc(Br)cc1
Show InChI InChI=1S/C16H10BrNO5S/c17-10-3-1-9(2-4-10)15-8-13(16(19)20)12-7-11(24(21,22)23)5-6-14(12)18-15/h1-8H,(H,19,20)(H,21,22,23)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Cubist Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Aminoacylation activity against human prolyl-tRNA synthetase


Bioorg Med Chem Lett 11: 541-4 (2001)


BindingDB Entry DOI: 10.7270/Q2Q23ZH8
More data for this
Ligand-Target Pair