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BDBM50220502 CHEMBL419646

SMILES: C[C@H](Nc1nc(N)nc(NC[C@H]2C[C@@H]2c2ccc(F)cc2)n1)c1ccccc1

InChI Key: InChIKey=JZHXBGPGAVVFBE-FDQGKXFDSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50220502   
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
Serotonin (5-HT) receptor


(Homo sapiens (human))
BDBM50220502
PNG
(CHEMBL419646)
Show SMILES C[C@H](Nc1nc(N)nc(NC[C@H]2C[C@@H]2c2ccc(F)cc2)n1)c1ccccc1
Show InChI InChI=1S/C21H23FN6/c1-13(14-5-3-2-4-6-14)25-21-27-19(23)26-20(28-21)24-12-16-11-18(16)15-7-9-17(22)10-8-15/h2-10,13,16,18H,11-12H2,1H3,(H4,23,24,25,26,27,28)/t13-,16+,18+/m0/s1
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a<50n/an/an/an/an/an/a



NPS Pharmaceuticals Inc.

Curated by ChEMBL


Assay Description
Compound was tested for its binding affinity towards human 5-hydroxytryptamine 7 receptor from HEK293 cells using radioligand [3H]LSD


Bioorg Med Chem Lett 12: 2451-4 (2002)


Article DOI: 10.1016/s0960-894x(02)00438-9
BindingDB Entry DOI: 10.7270/Q25T3JTZ
More data for this
Ligand-Target Pair