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BDBM347625 4-{[3-(4-Methoxyphenyl)azepan-1-yl]carbonyl}-N-methylpyridin-2-amine::US9790201, 110

SMILES: CNc1cc(ccn1)C(=O)N1CCCCC(C1)c1ccc(OC)cc1

InChI Key: InChIKey=UKZAVGYTVVWEKP-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 347625   
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
Prokineticin receptor 1


(Homo sapiens (Human))
BDBM347625
PNG
(4-{[3-(4-Methoxyphenyl)azepan-1-yl]carbonyl}-N-met...)
Show SMILES CNc1cc(ccn1)C(=O)N1CCCCC(C1)c1ccc(OC)cc1
Show InChI InChI=1S/C20H25N3O2/c1-21-19-13-16(10-11-22-19)20(24)23-12-4-3-5-17(14-23)15-6-8-18(25-2)9-7-15/h6-11,13,17H,3-5,12,14H2,1-2H3,(H,21,22)
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 450n/an/an/an/an/an/a



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
Prokineticin receptor 1 (PKR1) antagonists may be functionally assessed by measurement of change in intracellular calcium levels induced by Gq mediat...


US Patent US9790201 (2017)


BindingDB Entry DOI: 10.7270/Q2377BVZ
More data for this
Ligand-Target Pair