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BDBM238981 US9403833, 16

SMILES: Cc1c(NC(=O)c2nnn-3c2CCCc2cc(OC(F)(F)F)ccc-32)c(=O)n(C2CCCCC2)n1C

InChI Key: InChIKey=NOVSDVCDYPGXAQ-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 238981   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
E3 ubiquitin-protein ligase SMURF1 [420-757]


(Homo sapiens (Human))
BDBM238981
PNG
(US9403833, 16)
Show SMILES Cc1c(NC(=O)c2nnn-3c2CCCc2cc(OC(F)(F)F)ccc-32)c(=O)n(C2CCCCC2)n1C
Show InChI InChI=1S/C24H27F3N6O3/c1-14-20(23(35)33(31(14)2)16-8-4-3-5-9-16)28-22(34)21-19-10-6-7-15-13-17(36-24(25,26)27)11-12-18(15)32(19)30-29-21/h11-13,16H,3-10H2,1-2H3,(H,28,34)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 55n/an/an/an/an/a25



Novartis AG

US Patent


Assay Description
For the biochemical assay panel, 50 nl of the test compounds, reference compounds and buffer/DMSO control are transferred to the respective wells of ...


US Patent US9403833 (2016)


BindingDB Entry DOI: 10.7270/Q2PN94JM
More data for this
Ligand-Target Pair