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1 similar compounds to monomer 50097342

Compile data set for download or QSAR
Wt: 410.8
BDBM50167872

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50167872   
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
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50167872
PNG
(3-Chloro-4-[4-(4-pyrimidin-2-yl-3,6-dihydro-2H-pyr...)
Show SMILES ClC1=COc2ccccc2C(=O)N1CCCCN1CCC(=CC1)c1ncccn1
Show InChI InChI=1S/C22H23ClN4O2/c23-20-16-29-19-7-2-1-6-18(19)22(28)27(20)13-4-3-12-26-14-8-17(9-15-26)21-24-10-5-11-25-21/h1-2,5-8,10-11,16H,3-4,9,12-15H2
Reactome pathway
KEGG

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 494n/an/an/an/an/an/a



Daiichi Suntory Biomedical Research Co., Ltd

Curated by ChEMBL


Assay Description
Inhibitory concentration against Dopamine receptor D2 in rat striatum membrane using [3H]raclopride as radioligand


Bioorg Med Chem Lett 15: 2990-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.059
BindingDB Entry DOI: 10.7270/Q21Z456V
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50167872
PNG
(3-Chloro-4-[4-(4-pyrimidin-2-yl-3,6-dihydro-2H-pyr...)
Show SMILES ClC1=COc2ccccc2C(=O)N1CCCCN1CCC(=CC1)c1ncccn1
Show InChI InChI=1S/C22H23ClN4O2/c23-20-16-29-19-7-2-1-6-18(19)22(28)27(20)13-4-3-12-26-14-8-17(9-15-26)21-24-10-5-11-25-21/h1-2,5-8,10-11,16H,3-4,9,12-15H2
KEGG

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.38n/an/an/an/an/an/a



Daiichi Suntory Biomedical Research Co., Ltd

Curated by ChEMBL


Assay Description
Inhibitory concentration against 5-hydroxytryptamine 1A receptor in rat hippocampus membrane using [3H]-8-OH-DPAT as radioligand


Bioorg Med Chem Lett 15: 2990-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.059
BindingDB Entry DOI: 10.7270/Q21Z456V
More data for this
Ligand-Target Pair