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GLASS

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

Name	5-hydroxytryptamine receptor 4
Species	Homo sapiens (Human)
Gene	HTR4
Synonym	5-HT-4 5-hydroxytryptamine (serotonin) receptor 4, G protein-coupled 5-HT4 receptor 5-HT4 serotonin receptor 4
Disease	N/A
Length	388
Amino acid sequence	MDKLDANVSSEEGFGSVEKVVLLTFLSTVILMAILGNLLVMVAVCWDRQLRKIKTNYFIVSLAFADLLVSVLVMPFGAIELVQDIWIYGEVFCLVRTSLDVLLTTASIFHLCCISLDRYYAICCQPLVYRNKMTPLRIALMLGGCWVIPTFISFLPIMQGWNNIGIIDLIEKRKFNQNSNSTYCVFMVNKPYAITCSVVAFYIPFLLMVLAYYRIYVTAKEHAHQIQMLQRAGASSESRPQSADQHSTHRMRTETKAAKTLCIIMGCFCLCWAPFFVTNIVDPFIDYTVPGQVWTAFLWLGYINSGLNPFLYAFLNKSFRRAFLIILCCDDERYRRPSILGQTVPCSTTTINGSTHVLRDAVECGGQWESQCHPPATSPLVAAQPSDT
UniProt	Q13639
Protein Data Bank	N/A
GPCR-HGmod model	Q13639
3D structure model	This predicted structure model is from GPCR-EXP Q13639.
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL1875
IUPHAR	9
DrugBank	BE0000084

Ligand

Name	SDZ-205557
Molecular formula	C14H21ClN2O3
IUPAC name	2-(diethylamino)ethyl 4-amino-5-chloro-2-methoxybenzoate
Molecular weight	300.783
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	3.2
Synonyms	Lopac0_001153 NCGC00092301-03 Benzoic acid, 4-amino-5-chloro-2-methoxy-, 2-(diethylamino)ethyl ester BPBio1_000574 D0W8EP NCGC00015916-01 SCHEMBL1038983 2-(Diethylamino)ethyl 4-amino-5-chloro-2-methoxybenzoate AC1L1JSU CCG-205227 L001009 NCGC00015916-05 SDZ 205557 2-methoxy-4-amino-5-chloro-benzoic acid 2-(diethylamino) ethyl ester AKOS030238974 CHEMBL287045 LS-186950 PDSP1_001668 ZINC1544798 4-Amino-5-chloro-2-methoxy-benzoic acid 2-diethylamino-ethyl ester Benzoic acid,4-amino-5-chloro-2-methoxy-, 2-(diethylamino)ethyl ester BRD-K15868788-001-01-4 DTXSID90160102 NCGC00015916-03 Sdz 205,557 2-diethylaminoethyl 4-amino-5-chloro-2-methoxybenzoate AC1Q3LU5 CHEBI:92288 Lopac-S-174 NCGC00092301-02 SDZ-205-557 2-Methoxy-4-amino-5-chlorobenzoic acid 2-(diethylamino)ethyl ester BDBM50056401 Biomol-NT_000157 CTK4C0686 LS-187597 PDSP2_001652 137196-67-9 BRD-K15868788-003-02-8 GTPL258 NCGC00015916-04 SDZ 205-557 2-diethylaminoethyl [2-methoxy-4-amino-5-chloro]benzoate ACMC-20cut4 [ Show all ]
Inchi Key	FFNWMBDISAYHDC-UHFFFAOYSA-N
Inchi ID	InChI=1S/C14H21ClN2O3/c1-4-17(5-2)6-7-20-14(18)10-8-11(15)12(16)9-13(10)19-3/h8-9H,4-7,16H2,1-3H3
PubChem CID	5191
ChEMBL	CHEMBL287045
IUPHAR	258
BindingDB	50056401
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	6.3 nM	PMID8867105	PDSP,BindingDB
Ki	6.31 nM	PMID19261477	ChEMBL
pKb	7.3 -	Bioorg. Med. Chem. Lett., (1994) 4:20:2477	ChEMBL

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