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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50447837   
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
Retinoic acid receptor alpha


(Homo sapiens (Human))
BDBM50447837
PNG
(CHEMBL3114297)
Show SMILES Cc1cc(O)c(cc1-c1ncc(s1)-c1ccc(cc1)C(O)=O)C12CC3CC(CC(C3)C1)C2 |TLB:5:22:25:29.28.27,THB:23:24:27:31.22.30,23:22:25.24.29:27,30:22:25:29.28.27,30:28:25:31.23.22|
Show InChI InChI=1S/C27H27NO3S/c1-15-6-23(29)22(27-11-16-7-17(12-27)9-18(8-16)13-27)10-21(15)25-28-14-24(32-25)19-2-4-20(5-3-19)26(30)31/h2-6,10,14,16-18,29H,7-9,11-13H2,1H3,(H,30,31)
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.28E+3n/an/an/an/an/an/a



Universidade de Vigo

Curated by ChEMBL


Assay Description
Antagonist activity at Gal4-fused RARalpha (unknown origin) transfected in HEK293 cells assessed as inhibition of ATRA-induced transcriptional activi...


Bioorg Med Chem 22: 1285-302 (2014)


Article DOI: 10.1016/j.bmc.2014.01.006
BindingDB Entry DOI: 10.7270/Q26W9CK1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50447837
PNG
(CHEMBL3114297)
Show SMILES Cc1cc(O)c(cc1-c1ncc(s1)-c1ccc(cc1)C(O)=O)C12CC3CC(CC(C3)C1)C2 |TLB:5:22:25:29.28.27,THB:23:24:27:31.22.30,23:22:25.24.29:27,30:22:25:29.28.27,30:28:25:31.23.22|
Show InChI InChI=1S/C27H27NO3S/c1-15-6-23(29)22(27-11-16-7-17(12-27)9-18(8-16)13-27)10-21(15)25-28-14-24(32-25)19-2-4-20(5-3-19)26(30)31/h2-6,10,14,16-18,29H,7-9,11-13H2,1H3,(H,30,31)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 4.78E+3n/an/an/an/an/an/a



Universidade de Vigo

Curated by ChEMBL


Assay Description
Inhibition of recombinant IKKbeta (unknown origin) using ulight-IkappaomegaBalpha as substrate after 2 hrs by LANCE ultra TR-FRET assay


Bioorg Med Chem 22: 1285-302 (2014)


Article DOI: 10.1016/j.bmc.2014.01.006
BindingDB Entry DOI: 10.7270/Q26W9CK1
More data for this
Ligand-Target Pair