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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 = 'BDBM100778'   
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))
BDBM100778
PNG
(US8507535, 17)
Show SMILES C[C@]1(COc2ccc(Cl)cn2)CN(C[C@@H]1c1ccc(Cl)cc1)C(=O)C1CCN(CC1)c1ccc(cc1)C#N |r|
Show InChI InChI=1S/C30H30Cl2N4O2/c1-30(20-38-28-11-8-25(32)17-34-28)19-36(18-27(30)22-4-6-24(31)7-5-22)29(37)23-12-14-35(15-13-23)26-9-2-21(16-33)3-10-26/h2-11,17,23,27H,12-15,18-20H2,1H3/t27-,30-/m1/s1
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Similars

US Patent
2.30n/an/an/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
Competition binding assay using hNK3 receptor.


US Patent US8507535 (2013)


BindingDB Entry DOI: 10.7270/Q27H1H67
More data for this
Ligand-Target Pair