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BDBM42409 1-[1-(1-Cyclopentyl-1H-tetrazol-5-yl)-3-methyl-butyl]-4-(2-fluoro-phenyl)-piperazine::1-[1-(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)-3-methyl-butyl]-4-(2-fluorophenyl)piperazine;hydrochloride::1-[1-(1-cyclopentyl-5-tetrazolyl)-3-methylbutyl]-4-(2-fluorophenyl)piperazine;hydrochloride::1-[1-(1-cyclopentyltetrazol-5-yl)-3-methyl-butyl]-4-(2-fluorophenyl)piperazine;hydrochloride::1-[1-(1-cyclopentyltetrazol-5-yl)-3-methylbutyl]-4-(2-fluorophenyl)piperazine;hydrochloride::MLS000031083::SMR000004853::cid_6602593

SMILES: CC(C)CC(N1CCN(CC1)c1ccccc1F)c1nnnn1C1CCCC1

InChI Key: InChIKey=IJJTXVLTYBRQSS-UHFFFAOYSA-N

Data: 2 IC50

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 = 42409   
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
Neuropeptide Y receptor type 2


(Homo sapiens (Human))
BDBM42409
PNG
(1-[1-(1-Cyclopentyl-1H-tetrazol-5-yl)-3-methyl-but...)
Show SMILES CC(C)CC(N1CCN(CC1)c1ccccc1F)c1nnnn1C1CCCC1
Show InChI InChI=1S/C21H31FN6/c1-16(2)15-20(21-23-24-25-28(21)17-7-3-4-8-17)27-13-11-26(12-14-27)19-10-6-5-9-18(19)22/h5-6,9-10,16-17,20H,3-4,7-8,11-15H2,1-2H3
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PC cid
PC sid
UniChem
PCBioAssay
n/an/a 2.44E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2V1235Z
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))
BDBM42409
PNG
(1-[1-(1-Cyclopentyl-1H-tetrazol-5-yl)-3-methyl-but...)
Show SMILES CC(C)CC(N1CCN(CC1)c1ccccc1F)c1nnnn1C1CCCC1
Show InChI InChI=1S/C21H31FN6/c1-16(2)15-20(21-23-24-25-28(21)17-7-3-4-8-17)27-13-11-26(12-14-27)19-10-6-5-9-18(19)22/h5-6,9-10,16-17,20H,3-4,7-8,11-15H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem
PCBioAssay
n/an/a<3.50E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2ZS2TWK
More data for this
Ligand-Target Pair