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GLASS

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

Name	Taste receptor type 2 member 14
Species	Homo sapiens (Human)
Gene	TAS2R14
Synonym	T2R14 TAS2R14 Taste receptor family B member 1 taste receptor, type 2, member 14 TRB1
Disease	N/A
Length	317
Amino acid sequence	MGGVIKSIFTFVLIVEFIIGNLGNSFIALVNCIDWVKGRKISSVDRILTALAISRISLVWLIFGSWCVSVFFPALFATEKMFRMLTNIWTVINHFSVWLATGLGTFYFLKIANFSNSIFLYLKWRVKKVVLVLLLVTSVFLFLNIALINIHINASINGYRRNKTCSSDSSNFTRFSSLIVLTSTVFIFIPFTLSLAMFLLLIFSMWKHRKKMQHTVKISGDASTKAHRGVKSVITFFLLYAIFSLSFFISVWTSERLEENLIILSQVMGMAYPSCHSCVLILGNKKLRQASLSVLLWLRYMFKDGEPSGHKEFRESS
UniProt	Q9NYV8
Protein Data Bank	N/A
GPCR-HGmod model	Q9NYV8
3D structure model	This predicted structure model is from GPCR-EXP Q9NYV8.
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL3309105
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	4-{[{[(3-chloro-4-methylphenyl)amino]carbonothioyl}(4-methoxybenzyl)amino]methyl}cyclohexanecarboxylic acid
Molecular formula	C24H29ClN2O3S
IUPAC name	4-[[(3-chloro-4-methylphenyl)carbamothioyl-[(4-methoxyphenyl)methyl]amino]methyl]cyclohexane-1-carboxylic acid
Molecular weight	461.017
Hydrogen bond acceptor	4
Hydrogen bond donor	2
XlogP	5.2
Synonyms	CHEMBL1323541 US9247759, 5-111 MolPort-007-929-133 BDBM211165 SR-01000582762 HMS2698K18 ZINC3036022 AC1N2R2O SCHEMBL1649775 SR-01000582762-1 4-[[(3-chloro-4-methylphenyl)carbamothioyl-[(4-methoxyphenyl)methyl]amino]methyl]cyclohexane-1-carboxylic acid MLS000673573 AKOS002117272 SMR000314814 [ Show all ]
Inchi Key	UWOJQANBRFCVCC-UHFFFAOYSA-N
Inchi ID	InChI=1S/C24H29ClN2O3S/c1-16-3-10-20(13-22(16)25)26-24(31)27(15-18-6-11-21(30-2)12-7-18)14-17-4-8-19(9-5-17)23(28)29/h3,6-7,10-13,17,19H,4-5,8-9,14-15H2,1-2H3,(H,26,31)(H,28,29)
PubChem CID	4075726
ChEMBL	CHEMBL1323541
IUPHAR	N/A
BindingDB	211165
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has a partition coefficient log P greater than 5.

Experimental Data

Parameter	Value	Reference	Database source
IC50	6136.0 nM	N/A	BindingDB
IC50	6136.0 nM	None	ChEMBL

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