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SMILES: FC(F)(F)c1cccc(c1)C(=O)C1CCCN(Cc2cccn2-c2ncccn2)C1

InChI Key: InChIKey=UOHIYKMFFCGXJM-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 89157   
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
High affinity choline transporter 1


(Homo sapiens (Human))		BDBM89157
PNG
(MLS000731795 | SMR000317543 | [1-[(1-pyrimidin-2-y...)
Show SMILES FC(F)(F)c1cccc(c1)C(=O)C1CCCN(Cc2cccn2-c2ncccn2)C1
Show InChI InChI=1S/C22H21F3N4O/c23-22(24,25)18-7-1-5-16(13-18)20(30)17-6-2-11-28(14-17)15-19-8-3-12-29(19)21-26-9-4-10-27-21/h1,3-5,7-10,12-13,17H,2,6,11,14-15H2
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PC cid
PC sid
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n/an/an/an/a 6.69E+3n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
Data Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center Affiliation: Johns Hopkins University, School of Medicine Screening ...

PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q21N7ZQ4
More data for this
Ligand-Target Pair