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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Retinoic acid receptor alpha' and Monomerid = 50075353   
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
Retinoid X receptor gamma/retinoic acid receptor alpha


(Homo sapiens (Human))
BDBM50075353
PNG
(4-[8-(4-Cyano-phenyl)-5,5-dimethyl-5,6-dihydro-nap...)
Show SMILES CC1(C)CC=C(c2ccc(cc2)C#N)c2cc(ccc12)C#Cc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C28H21NO2/c1-28(2)16-15-24(22-10-7-21(18-29)8-11-22)25-17-20(9-14-26(25)28)4-3-19-5-12-23(13-6-19)27(30)31/h5-15,17H,16H2,1-2H3,(H,30,31)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 38n/an/an/an/an/a



Allergan Inc.

Curated by ChEMBL


Assay Description
Ability to displace 3[H]-(all-E)-retinoic acid (5 nM) from alpha retinoic acid receptor (alpha RAR) using transactivation assay


Bioorg Med Chem Lett 9: 573-6 (1999)


Article DOI: 10.1016/s0960-894x(99)00047-5
BindingDB Entry DOI: 10.7270/Q2SN084D
More data for this
Ligand-Target Pair