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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Nuclear receptor coactivator 1' and Ligand = 'BDBM87337'   
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
Nuclear receptor coactivator 1


(Homo sapiens (Human))
BDBM87337
PNG
(4-[2-(2,2,6-trimethyl-8-oxidanylidene-3,4-dihydrop...)
Show SMILES Cc1c(CC(=O)NCCCC(O)=O)c(=O)oc2cc3OC(C)(C)CCc3cc12
Show InChI InChI=1S/C21H25NO6/c1-12-14-9-13-6-7-21(2,3)28-16(13)11-17(14)27-20(26)15(12)10-18(23)22-8-4-5-19(24)25/h9,11H,4-8,10H2,1-3H3,(H,22,23)(H,24,25)
PDB
MMDB

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PCBioAssay
n/an/a 9.05E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q28914F2
More data for this
Ligand-Target Pair