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BDBM121156 US8722896, (+/-)-2-Methyl-3-(1-((2- methoxypyridin-3- ylmethyl)amino)-N-(9- chloro-3,4-dihydro-2H-1,5- benzodioxepin-7-ylmethyl)-N- isobutylpropanamide

SMILES: COc1ncccc1CNCC(C)C(=O)N(CC(C)C)Cc1cc(Cl)c2OCCCOc2c1

InChI Key: InChIKey=AJVTYHYPVKOHDL-UHFFFAOYSA-N

Data: 3 KI

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 3 hits for monomerid = 121156   
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 2 (PRK2)


(Cricetulus griseus (Chinese hamster))
BDBM121156
PNG
(US8722896, (+/-)-2-Methyl-3-(1-((2- methoxypyridin...)
Show SMILES COc1ncccc1CNCC(C)C(=O)N(CC(C)C)Cc1cc(Cl)c2OCCCOc2c1
Show InChI InChI=1S/C25H34ClN3O4/c1-17(2)15-29(16-19-11-21(26)23-22(12-19)32-9-6-10-33-23)25(30)18(3)13-27-14-20-7-5-8-28-24(20)31-4/h5,7-8,11-12,17-18,27H,6,9-10,13-16H2,1-4H3
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
1.06 -12.7n/an/an/an/an/an/a37



The Regents of the University of California

US Patent


Assay Description
An aequorin-based luminescent assay for calcium mobilization was used to measure mobilization of intracellular Ca2+ (Bullock et al., Mol Pharmacol 65...


US Patent US8722896 (2014)


BindingDB Entry DOI: 10.7270/Q29G5KGF
More data for this
Ligand-Target Pair
Prokineticin receptor 2 (PRK2)


(Cricetulus griseus (Chinese hamster))
BDBM121156
PNG
(US8722896, (+/-)-2-Methyl-3-(1-((2- methoxypyridin...)
Show SMILES COc1ncccc1CNCC(C)C(=O)N(CC(C)C)Cc1cc(Cl)c2OCCCOc2c1
Show InChI InChI=1S/C25H34ClN3O4/c1-17(2)15-29(16-19-11-21(26)23-22(12-19)32-9-6-10-33-23)25(30)18(3)13-27-14-20-7-5-8-28-24(20)31-4/h5,7-8,11-12,17-18,27H,6,9-10,13-16H2,1-4H3
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
1.82 -12.4n/an/an/an/an/an/a37



The Regents of the University of California

US Patent


Assay Description
An aequorin-based luminescent assay for calcium mobilization was used to measure mobilization of intracellular Ca2+ (Bullock et al., Mol Pharmacol 65...


US Patent US8722896 (2014)


BindingDB Entry DOI: 10.7270/Q29G5KGF
More data for this
Ligand-Target Pair
Prokineticin receptor 1 (PRK1)


(Cricetulus griseus (Chinese hamster))
BDBM121156
PNG
(US8722896, (+/-)-2-Methyl-3-(1-((2- methoxypyridin...)
Show SMILES COc1ncccc1CNCC(C)C(=O)N(CC(C)C)Cc1cc(Cl)c2OCCCOc2c1
Show InChI InChI=1S/C25H34ClN3O4/c1-17(2)15-29(16-19-11-21(26)23-22(12-19)32-9-6-10-33-23)25(30)18(3)13-27-14-20-7-5-8-28-24(20)31-4/h5,7-8,11-12,17-18,27H,6,9-10,13-16H2,1-4H3
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
44.8 -10.4n/an/an/an/an/an/a37



The Regents of the University of California

US Patent


Assay Description
An aequorin-based luminescent assay for calcium mobilization was used to measure mobilization of intracellular Ca2+ (Bullock et al., Mol Pharmacol 65...


US Patent US8722896 (2014)


BindingDB Entry DOI: 10.7270/Q29G5KGF
More data for this
Ligand-Target Pair