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BDBM297547 2-{[4-[4-(2-dimethylamino- phenyl)-piperidin-1-yl]-2-(1- trifluoromethyl-cyclopropyl)- quinazolin-6-yl]-methyl-amino}- ethanol::US10118902, Example 49::US10584103, Example 49

SMILES: CN(C)c1ccccc1C1CCN(CC1)c1nc(nc2ccc(cc12)N(C)CCO)C1(CC1)C(F)(F)F

InChI Key: InChIKey=LZHJOPRARNCKCR-UHFFFAOYSA-N

Data: 2 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 297547   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Dopamine receptor D2L/neurotensin receptor NTS1


(Homo sapiens (Human))
BDBM297547
PNG
(2-{[4-[4-(2-dimethylamino- phenyl)-piperidin-1-yl]...)
Show SMILES CN(C)c1ccccc1C1CCN(CC1)c1nc(nc2ccc(cc12)N(C)CCO)C1(CC1)C(F)(F)F
Show InChI InChI=1S/C28H34F3N5O/c1-34(2)24-7-5-4-6-21(24)19-10-14-36(15-11-19)25-22-18-20(35(3)16-17-37)8-9-23(22)32-26(33-25)27(12-13-27)28(29,30)31/h4-9,18-19,37H,10-17H2,1-3H3
PDB

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UniProtKB/SwissProt

antibodypedia
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PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 1.25E+3n/an/an/an/a



SANFORD BURNHAM PREBYS MEDICAL DISCOVERY INSTITUTE

US Patent


Assay Description
NTSR1 (NTR1) CHO cells are plated in 20 μL of assay media containing Ham's F12 supplemented with 10% fetal bovine serum and 0.4 mg/mL G418 a...


US Patent US10584103 (2020)


BindingDB Entry DOI: 10.7270/Q2M90C36
More data for this
Ligand-Target Pair
Dopamine receptor D2L/neurotensin receptor NTS1


(Homo sapiens (Human))
BDBM297547
PNG
(2-{[4-[4-(2-dimethylamino- phenyl)-piperidin-1-yl]...)
Show SMILES CN(C)c1ccccc1C1CCN(CC1)c1nc(nc2ccc(cc12)N(C)CCO)C1(CC1)C(F)(F)F
Show InChI InChI=1S/C28H34F3N5O/c1-34(2)24-7-5-4-6-21(24)19-10-14-36(15-11-19)25-22-18-20(35(3)16-17-37)8-9-23(22)32-26(33-25)27(12-13-27)28(29,30)31/h4-9,18-19,37H,10-17H2,1-3H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 1.25E+3n/an/an/an/a



Sanford Burnham Prebys Medical Discovery Institute

US Patent


Assay Description
NTSR1 (NTR1) CHO cells are plated in 20 uL of assay media containing Ham's F12 supplemented with 10% fetal bovine serum and 0.4 mg/mL G418 at a c...


US Patent US10118902 (2018)


BindingDB Entry DOI: 10.7270/Q27946Q9
More data for this
Ligand-Target Pair