BindingDB logo
myBDB logout

BDBM50275167 CHEMBL458114::N-(5-chloro-2-methoxyphenyl)-2-hydroxy-3-nitro-benzamide::cid_186169

SMILES: COc1ccc(Cl)cc1NC(=O)c1cccc(c1O)[N+]([O-])=O

InChI Key: InChIKey=SXKNMJHRHWIFCI-UHFFFAOYSA-N

Data: 1 KI  2 IC50  1 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 4 hits for monomerid = 50275167   
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
Thermolysin


(Bacillus thermoproteolyticus)
BDBM50275167
PNG
(CHEMBL458114 | N-(5-chloro-2-methoxyphenyl)-2-hydr...)
Show SMILES COc1ccc(Cl)cc1NC(=O)c1cccc(c1O)[N+]([O-])=O
Show InChI InChI=1S/C14H11ClN2O5/c1-22-12-6-5-8(15)7-10(12)16-14(19)9-3-2-4-11(13(9)18)17(20)21/h2-7,18H,1H3,(H,16,19)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
8.14E+6n/an/an/an/an/an/an/an/a



University of Tromsø

Curated by ChEMBL


Assay Description
Inhibition of Bacillus thermoproteolyticus thermolysin


J Med Chem 52: 48-61 (2009)


Article DOI: 10.1021/jm8008019
BindingDB Entry DOI: 10.7270/Q28P60BR
More data for this
Ligand-Target Pair
Thermolysin


(Bacillus thermoproteolyticus)
BDBM50275167
PNG
(CHEMBL458114 | N-(5-chloro-2-methoxyphenyl)-2-hydr...)
Show SMILES COc1ccc(Cl)cc1NC(=O)c1cccc(c1O)[N+]([O-])=O
Show InChI InChI=1S/C14H11ClN2O5/c1-22-12-6-5-8(15)7-10(12)16-14(19)9-3-2-4-11(13(9)18)17(20)21/h2-7,18H,1H3,(H,16,19)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 8.14E+7n/an/an/an/an/an/a



University of Tromsø

Curated by ChEMBL


Assay Description
Inhibition of Bacillus thermoproteolyticus thermolysin


J Med Chem 52: 48-61 (2009)


Article DOI: 10.1021/jm8008019
BindingDB Entry DOI: 10.7270/Q28P60BR
More data for this
Ligand-Target Pair
corticotropin releasing factor-binding protein


(Homo sapiens (Human))
BDBM50275167
PNG
(CHEMBL458114 | N-(5-chloro-2-methoxyphenyl)-2-hydr...)
Show SMILES COc1ccc(Cl)cc1NC(=O)c1cccc(c1O)[N+]([O-])=O
Show InChI InChI=1S/C14H11ClN2O5/c1-22-12-6-5-8(15)7-10(12)16-14(19)9-3-2-4-11(13(9)18)17(20)21/h2-7,18H,1H3,(H,16,19)
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PCBioAssay
n/an/an/an/a>5.30E+4n/an/an/an/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 (2012)


BindingDB Entry DOI: 10.7270/Q2VX0F3D
More data for this
Ligand-Target Pair
corticotropin releasing factor-binding protein


(Homo sapiens (Human))
BDBM50275167
PNG
(CHEMBL458114 | N-(5-chloro-2-methoxyphenyl)-2-hydr...)
Show SMILES COc1ccc(Cl)cc1NC(=O)c1cccc(c1O)[N+]([O-])=O
Show InChI InChI=1S/C14H11ClN2O5/c1-22-12-6-5-8(15)7-10(12)16-14(19)9-3-2-4-11(13(9)18)17(20)21/h2-7,18H,1H3,(H,16,19)
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PCBioAssay
n/an/a 8.13E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2NC5ZS3
More data for this
Ligand-Target Pair