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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

Name	Trace amine-associated receptor 1
Species	Rattus norvegicus (Rat)
Gene	Taar1
Synonym	TA1 receptor TaR-1 TAR1 Trace amine receptor 1 TRAR1
Disease	N/A for non-human GPCRs
Length	332
Amino acid sequence	MHLCHNSANISHTNSNWSRDVRASLYSLISLIILTTLVGNLIVIISISHFKQLHTPTNWLLHSMAVVDFLLGCLVMPYSMVRTVEHCWYFGELFCKLHTSTDIMLSSASILHLAFISIDRYYAVCDPLRYKAKINLAAIFVMILISWSLPAVFAFGMIFLELNLEGVEELYHNQVFCLRGCFPFFSKVSGVLAFMTSFYIPGSVMLFVYYRIYFIAKGQARSINRANLQVGLEGESRAPQSKETKAAKTLGIMVGVFLLCWCPFFFCMVLDPFLGYVIPPTLNDTLNWFGYLNSAFNPMVYAFFYPWFRRALKMVLFGKIFQKDSSRSKLFL
UniProt	Q923Y9
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL3833
IUPHAR	364
DrugBank	N/A

Ligand

Name	SCHEMBL6919602
Molecular formula	C18H19F2N3O
IUPAC name	3,5-difluoro-N-[4-(2-pyrrolidin-3-ylethyl)phenyl]pyridine-2-carboxamide
Molecular weight	331.367
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	2.8
Synonyms	US9452980, 133 CHEMBL3907834 BDBM250223
Inchi Key	APWHZOSSXYMDSS-UHFFFAOYSA-N
Inchi ID	InChI=1S/C18H19F2N3O/c19-14-9-16(20)17(22-11-14)18(24)23-15-5-3-12(4-6-15)1-2-13-7-8-21-10-13/h3-6,9,11,13,21H,1-2,7-8,10H2,(H,23,24)
PubChem CID	67241233
ChEMBL	CHEMBL3907834
IUPHAR	N/A
BindingDB	250223
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Ki	17.4 nM	, None	BindingDB,ChEMBL

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