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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Photoreceptor-specific nuclear receptor' and Ligand = 'BDBM50192211'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Photoreceptor-specific nuclear receptor


(Homo sapiens (Human))
BDBM50192211
PNG
(2-chloro-N-(3-{5-[(2-chlorobenzene)amido]-1H-1,3-b...)
Show SMILES Clc1ccccc1C(=O)Nc1cccc(c1)-c1nc2ccc(NC(=O)c3ccccc3Cl)cc2[nH]1
Show InChI InChI=1S/C27H18Cl2N4O2/c28-21-10-3-1-8-19(21)26(34)30-17-7-5-6-16(14-17)25-32-23-13-12-18(15-24(23)33-25)31-27(35)20-9-2-4-11-22(20)29/h1-15H,(H,30,34)(H,31,35)(H,32,33)
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PC cid
PC sid
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Similars

Article
PubMed
n/an/an/an/a 4.10E+3n/an/an/an/a



Merck & Co.

Curated by ChEMBL


Assay Description
Agonist activity at NR2E3 by luciferase NCOR release assay in CHO cells


Bioorg Med Chem Lett 16: 5001-4 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.056
BindingDB Entry DOI: 10.7270/Q280528D
More data for this
Ligand-Target Pair
Photoreceptor-specific nuclear receptor


(Homo sapiens (Human))
BDBM50192211
PNG
(2-chloro-N-(3-{5-[(2-chlorobenzene)amido]-1H-1,3-b...)
Show SMILES Clc1ccccc1C(=O)Nc1cccc(c1)-c1nc2ccc(NC(=O)c3ccccc3Cl)cc2[nH]1
Show InChI InChI=1S/C27H18Cl2N4O2/c28-21-10-3-1-8-19(21)26(34)30-17-7-5-6-16(14-17)25-32-23-13-12-18(15-24(23)33-25)31-27(35)20-9-2-4-11-22(20)29/h1-15H,(H,30,34)(H,31,35)(H,32,33)
PDB

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KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/an/an/a 1.00E+4n/an/an/an/a



Merck & Co.

Curated by ChEMBL


Assay Description
Agonist activity at NR2E3 by beta lactamase transactivation assay


Bioorg Med Chem Lett 16: 5001-4 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.056
BindingDB Entry DOI: 10.7270/Q280528D
More data for this
Ligand-Target Pair