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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'G-protein coupled receptor 6' and Ligand = 'BDBM382109'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM382109
PNG
(5-(4-(5-chloro-2-fluorobenzoyl)piperidin-1-yl)-3-c...)
Show SMILES CC(C)Nc1nc(C(=O)N(C)C)c(nc1N1CCC(CC1)C(=O)c1cc(Cl)ccc1F)C#N
Show InChI InChI=1S/C23H26ClFN6O2/c1-13(2)27-21-22(28-18(12-26)19(29-21)23(33)30(3)4)31-9-7-14(8-10-31)20(32)16-11-15(24)5-6-17(16)25/h5-6,11,13-14H,7-10H2,1-4H3,(H,27,29)
UniProtKB/SwissProt
UniProtKB/TrEMBL

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 2.30E+4n/an/an/an/a



Takeda Pharmaceutical Co., Ltd

US Patent


Assay Description
This cell based assay measures the ability of compounds to inhibit the constitutive cAMP activity of GPR6 receptor expressed in CHO-K1 cells. CHO cel...


US Patent US10273225 (2019)


BindingDB Entry DOI: 10.7270/Q24X5B3J
More data for this
Ligand-Target Pair
G-protein coupled receptor 6


(Homo sapiens (Human))
BDBM382109
PNG
(5-(4-(5-chloro-2-fluorobenzoyl)piperidin-1-yl)-3-c...)
Show SMILES CC(C)Nc1nc(C(=O)N(C)C)c(nc1N1CCC(CC1)C(=O)c1cc(Cl)ccc1F)C#N
Show InChI InChI=1S/C23H26ClFN6O2/c1-13(2)27-21-22(28-18(12-26)19(29-21)23(33)30(3)4)31-9-7-14(8-10-31)20(32)16-11-15(24)5-6-17(16)25/h5-6,11,13-14H,7-10H2,1-4H3,(H,27,29)
UniProtKB/SwissProt
UniProtKB/TrEMBL

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 2.30E+4n/an/an/an/a



Takeda Pharmaceutical Co., Ltd

US Patent


Assay Description
This cell based assay measures the ability of compounds to inhibit the constitutive cAMP activity of GPR6 receptor expressed in CHO-K1 cells. CHO cel...


US Patent US10000468 (2018)


BindingDB Entry DOI: 10.7270/Q23R0W71
More data for this
Ligand-Target Pair