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Compile Data Set for Download or QSAR

Found 1 hit of ki for monomerid = 50217051   
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
Substance-P receptor


(Homo sapiens (Human))
BDBM50217051
PNG
(CHEMBL432007)
Show SMILES FC(F)(F)c1cc(CN2C(=O)C3CN(C(=O)COCc4ccccc4)C4(CCNCC4)C3C2=O)cc(c1)C(F)(F)F
Show InChI InChI=1S/C28H27F6N3O4/c29-27(30,31)19-10-18(11-20(12-19)28(32,33)34)13-36-24(39)21-14-37(22(38)16-41-15-17-4-2-1-3-5-17)26(23(21)25(36)40)6-8-35-9-7-26/h1-5,10-12,21,23,35H,6-9,13-16H2
PDB
MMDB

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PC cid
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Similars

PubMed
2.29E+3n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche AG

Curated by ChEMBL


Assay Description
Affinity for human Tachykinin receptor 1 expressed in CHO cells


Bioorg Med Chem Lett 12: 3073-6 (2002)


BindingDB Entry DOI: 10.7270/Q23N25J3
More data for this
Ligand-Target Pair