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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Neuromedin-K receptor' and Ligand = 'BDBM109711'   
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
Neuromedin-K receptor


(Homo sapiens (Human))
BDBM109711
PNG
(US8618303, 1)
Show SMILES CC(C)C(=O)N1CCC(CC1)C(=O)N1C[C@H](c2ccc(Cl)cc2)[C@](C)(C1)N(C)C(=O)Oc1ccc(F)cc1 |r|
Show InChI InChI=1S/C29H35ClFN3O4/c1-19(2)26(35)33-15-13-21(14-16-33)27(36)34-17-25(20-5-7-22(30)8-6-20)29(3,18-34)32(4)28(37)38-24-11-9-23(31)10-12-24/h5-12,19,21,25H,13-18H2,1-4H3/t25-,29+/m1/s1
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Similars

US Patent
10.5n/an/an/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
hNK3 receptor binding experiment were performed using [3H]SR142801 (Catalog No. TRK1035, specific activity: 74.0 Ci/mmol, Amersham, GE Healthcare UK ...


US Patent US8618303 (2013)


BindingDB Entry DOI: 10.7270/Q2TB15KK
More data for this
Ligand-Target Pair