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BDBM31036 2-[(4-phenyl-1-piperazinyl)methyl]imidazo[1,2-a]pyrimidine::2-[(4-phenylpiperazin-1-yl)methyl]imidazo[1,2-a]pyrimidine::2-[(4-phenylpiperazino)methyl]imidazo[1,2-a]pyrimidine::MLS000100989::SMR000017404::cid_916985

SMILES: C(N1CCN(CC1)c1ccccc1)c1cn2cccnc2n1

InChI Key: InChIKey=PDWPQVUNIFZQKW-UHFFFAOYSA-N

Data: 3 EC50

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 = 31036   
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
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM31036
PNG
(2-[(4-phenyl-1-piperazinyl)methyl]imidazo[1,2-a]py...)
Show SMILES C(N1CCN(CC1)c1ccccc1)c1cn2cccnc2n1
Show InChI InChI=1S/C17H19N5/c1-2-5-16(6-3-1)21-11-9-20(10-12-21)13-15-14-22-8-4-7-18-17(22)19-15/h1-8,14H,9-13H2
PDB

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PCBioAssay
n/an/an/an/a 5.00E+4n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
A cell line containing the human 5-HT1a receptor, the promiscuous G-alpha-15 protein (Ga15) as well as the beta-lactamase (BLA) reporter-gene under c...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2WW7G03
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))
BDBM31036
PNG
(2-[(4-phenyl-1-piperazinyl)methyl]imidazo[1,2-a]py...)
Show SMILES C(N1CCN(CC1)c1ccccc1)c1cn2cccnc2n1
Show InChI InChI=1S/C17H19N5/c1-2-5-16(6-3-1)21-11-9-20(10-12-21)13-15-14-22-8-4-7-18-17(22)19-15/h1-8,14H,9-13H2
PDB

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KEGG

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antibodypedia
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UniChem

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PCBioAssay
n/an/an/an/a>4.00E+4n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
External Assay ID: S1P3_EC50_CS_5HT1e_Agonist Name: S1P3 Dose Response Assay Counterscreen for 5-Hydroxytryptamine(Serotonin) Receptor Subtype 1E ...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2PN941W
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Homo sapiens (Human))
BDBM31036
PNG
(2-[(4-phenyl-1-piperazinyl)methyl]imidazo[1,2-a]py...)
Show SMILES C(N1CCN(CC1)c1ccccc1)c1cn2cccnc2n1
Show InChI InChI=1S/C17H19N5/c1-2-5-16(6-3-1)21-11-9-20(10-12-21)13-15-14-22-8-4-7-18-17(22)19-15/h1-8,14H,9-13H2
PDB

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KEGG

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antibodypedia
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UniChem

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PCBioAssay
n/an/an/an/a 1.07E+3n/an/a7.423



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
The CHO cell line was cultured in T-175 sq cm Corning flasks (part 431080) at 37 deg C and 95% RH. The HTS assay began by dispensing 10 microliters o...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2Q52MZM
More data for this
Ligand-Target Pair