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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 1A
Species	Homo sapiens (Human)
Gene	HTR1A
Synonym	5-HT-1A 5-HT1A serotonin receptor 1A 5-HT1A receptor 5-hydroxytryptamine (serotonin) receptor 1A, G protein-coupled Gpcr18 ADRB2RL1 ADRBRL1 G-21 [ Show all ]
Disease	Urinary incontinence Generalized anxiety disorder Generalized anxiety disorder; Social phobia Hypertension Hypoactive sexual desire disorder Major depressive disorder Major depressive disorder; Episode; Anxiety Migraine Mood disorder Pain Parkinson's disease Premature ejaculation Psychiatric disorder Psychotic disorders Schizoaffective disorder; Schizophrenia Severe mood disorders Unspecified Female sexual dysfunction Eating disorder Schizophrenia Alzheimer disease Alzheimer disease; Peripheral sensory neuropathies; Lateral sclerosis Bulimia nervosa; Severe mood disorders Cervical dystonia; Spasm Cognitive disorders Anxiety disorder Depression Coronary artery disease [ Show all ]
Length	422
Amino acid sequence	MDVLSPGQGNNTTSPPAPFETGGNTTGISDVTVSYQVITSLLLGTLIFCAVLGNACVVAAIALERSLQNVANYLIGSLAVTDLMVSVLVLPMAALYQVLNKWTLGQVTCDLFIALDVLCCTSSILHLCAIALDRYWAITDPIDYVNKRTPRRAAALISLTWLIGFLISIPPMLGWRTPEDRSDPDACTISKDHGYTIYSTFGAFYIPLLLMLVLYGRIFRAARFRIRKTVKKVEKTGADTRHGASPAPQPKKSVNGESGSRNWRLGVESKAGGALCANGAVRQGDDGAALEVIEVHRVGNSKEHLPLPSEAGPTPCAPASFERKNERNAEAKRKMALARERKTVKTLGIIMGTFILCWLPFFIVALVLPFCESSCHMPTLLGAIINWLGYSNSLLNPVIYAYFNKDFQNAFKKIIKCKFCRQ
UniProt	P08908
Protein Data Bank	N/A
GPCR-HGmod model	P08908
3D structure model	This predicted structure model is from GPCR-EXP P08908.
BioLiP	N/A
Therapeutic Target Database	T78709
ChEMBL	CHEMBL214
IUPHAR	1
DrugBank	BE0000291

Ligand

Name	Homocysteine thiolactone
Molecular formula	C4H7NOS
IUPAC name	(3S)-3-aminothiolan-2-one
Molecular weight	117.166
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	-0.1
Synonyms	10593-85-8 AK116252 S502 2338-04-7 BDBM86198 KIWQWJKWBHZMDT-VKHMYHEASA-N ZINC54009855 (3S)-3-aminodihydrothiophen-2(3H)-one AC1Q6HVW CTK8E0354 PDSP1_001273 (S)-3-Aminodihydrothiophen-2(3H)-one 1317AA AKOS006240739 homocysteine thiolactone hydrochloride SCHEMBL2167191 CAS_134505 L-Homocysteine thiolactone (3S)-3-aminothiolan-2-one AJ-112267 FCH932421 PDSP2_001257 06DCC220-D06A-4793-8958-6383A1C2218C 2(3H)-Thiophenone, 3-aminodihydro-, (S)- AX8133745 KB-211461 UNII-D5H88XF24X component KIWQWJKWBHZMDT-VKHMYHEASA-N AC1L34Q6 CHEBI:60315 NSC_134505 (S)-3-aminodihydro-2(3H)-thiophenone [ Show all ]
Inchi Key	KIWQWJKWBHZMDT-VKHMYHEASA-N
Inchi ID	InChI=1S/C4H7NOS/c5-3-1-2-7-4(3)6/h3H,1-2,5H2/t3-/m0/s1
PubChem CID	134505
ChEMBL	N/A
IUPHAR	N/A
BindingDB	86198
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	<10000.0 nM	PMID12649361	BindingDB

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