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BDBM121107 US8722896, (-)-(3R)-1-(Indolin-7-ylmethyl)- N-(9-chloro-3,4-dihydro-2H-1,5- benzodioxepin-7-ylmethyl)-N- isobutylpyrrolidine-3- carboxamide

SMILES: CC(C)CN(Cc1cc(Cl)c2OCCCOc2c1)C(=O)[C@@H]1CCN(Cc2cccc3CCNc23)C1

InChI Key: InChIKey=VUZXMDAJKTULPG-QWVACARCNA-N

Data: 2 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 2 hits for monomerid = 121107   
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))
BDBM121107
PNG
(US8722896, (-)-(3R)-1-(Indolin-7-ylmethyl)- N-(9-c...)
Show SMILES CC(C)CN(Cc1cc(Cl)c2OCCCOc2c1)C(=O)[C@@H]1CCN(Cc2cccc3CCNc23)C1
Show InChI InChI=1/C28H36ClN3O3/c1-19(2)15-32(16-20-13-24(29)27-25(14-20)34-11-4-12-35-27)28(33)23-8-10-31(18-23)17-22-6-3-5-21-7-9-30-26(21)22/h3,5-6,13-14,19,23,30H,4,7-12,15-18H2,1-2H3/t23-/s2
UniProtKB/TrEMBL

GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
2.87 -12.1n/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))
BDBM121107
PNG
(US8722896, (-)-(3R)-1-(Indolin-7-ylmethyl)- N-(9-c...)
Show SMILES CC(C)CN(Cc1cc(Cl)c2OCCCOc2c1)C(=O)[C@@H]1CCN(Cc2cccc3CCNc23)C1
Show InChI InChI=1/C28H36ClN3O3/c1-19(2)15-32(16-20-13-24(29)27-25(14-20)34-11-4-12-35-27)28(33)23-8-10-31(18-23)17-22-6-3-5-21-7-9-30-26(21)22/h3,5-6,13-14,19,23,30H,4,7-12,15-18H2,1-2H3/t23-/s2
UniProtKB/TrEMBL

GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
17.8 -11.0n/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