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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Neurogenic locus notch homolog protein 3' and Ligand = 'BDBM50074702'   
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
Neurogenic locus notch homolog protein 3


(Homo sapiens (Human))
BDBM50074702
PNG
(CHEMBL3410154)
Show SMILES CCC[C@@H]([C@@H](CC(F)(F)F)C(=O)N[C@H]1N=C(c2ccccc2)c2ccccc2N(C)C1=O)C(N)=O |r,t:14|
Show InChI InChI=1S/C25H27F3N4O3/c1-3-9-16(21(29)33)18(14-25(26,27)28)23(34)31-22-24(35)32(2)19-13-8-7-12-17(19)20(30-22)15-10-5-4-6-11-15/h4-8,10-13,16,18,22H,3,9,14H2,1-2H3,(H2,29,33)(H,31,34)/t16-,18+,22+/m0/s1
PDB

UniProtKB/SwissProt

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AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 24n/an/an/an/an/an/a



Bristol-Myers Squibb Research and Development

Curated by ChEMBL


Assay Description
Inhibition of Notch3 intracellular domain fragment transfected in human HeLa cells co-transfected with CBF1-PGL3 luciferase reporter vector by transa...


Bioorg Med Chem Lett 25: 1905-9 (2015)


Article DOI: 10.1016/j.bmcl.2015.03.038
BindingDB Entry DOI: 10.7270/Q2X92D18
More data for this
Ligand-Target Pair