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GPCR

Name	D(2) dopamine receptor
Species	Homo sapiens (Human)
Gene	DRD2
Synonym	dopamine receptor 2 Dopamine D2 receptor D2R D2A and D_2B D2(415) and D₂₍₄₄₄₎ D2 receptor [ Show all ]
Disease	Substance dependence Major depressive disorder Maintain blood pressure in hypotensive states Insomnia Inflammatory disease Inflammatory bowel disease Idiopathic thrombocytopenic purpura Hypertension; Angina pectoris Hypertension Hyperprolactinemia Huntington's disease Glaucoma Gastrointestinal problems Malignant phaeochromocytoma; Benign prostatic hypertrophy; Malignant essential hypertension Migraine headaches Nasal congestion Sexual dysfunction Schizophrenia; Schizoaffective disorders Schizophrenia; Bipolar disorder Schizophrenia Psychotic disorders Psychosis Postpartum haemorrhage Peripheral vasoconstriction; Pulmonary hypertension Parkinson's disease Pain; Inflammatory diseases Ophthalmic disease Non-small cell lung cancer Nausea; Vomiting Fibrosis False perceptions; Bipolar disorder Emesis Chronic obstructive pulmonary disease Cerebrovascular ischaemia Cardiotonic Cardiac failure Bacterial infections Breast cancer Bipolar disorder; Schizophrenia Bipolar disorder Corneal vascularity; Hyperaemia; Itching Asthma; Bronchitis Anxiety disorder Carcinoid syndrome; Acromegaly Advanced stage Parkinson's disease Dermal necrosis Depressive fatigue Alcohol use disorders Allergy Alzheimer disease Hypotension [ Show all ]
Length	443
Amino acid sequence	MDPLNLSWYDDDLERQNWSRPFNGSDGKADRPHYNYYATLLTLLIAVIVFGNVLVCMAVSREKALQTTTNYLIVSLAVADLLVATLVMPWVVYLEVVGEWKFSRIHCDIFVTLDVMMCTASILNLCAISIDRYTAVAMPMLYNTRYSSKRRVTVMISIVWVLSFTISCPLLFGLNNADQNECIIANPAFVVYSSIVSFYVPFIVTLLVYIKIYIVLRRRRKRVNTKRSSRAFRAHLRAPLKGNCTHPEDMKLCTVIMKSNGSFPVNRRRVEAARRAQELEMEMLSSTSPPERTRYSPIPPSHHQLTLPDPSHHGLHSTPDSPAKPEKNGHAKDHPKIAKIFEIQTMPNGKTRTSLKTMSRRKLSQQKEKKATQMLAIVLGVFIICWLPFFITHILNIHCDCNIPPVLYSAFTWLGYVNSAVNPIIYTTFNIEFRKAFLKILHC
UniProt	P14416
Protein Data Bank	6cm4, 6c38
GPCR-HGmod model	P14416
3D structure model	This structure is from PDB ID 6cm4.
BioLiP	BL0408379, BL0403379
Therapeutic Target Database	T67162
ChEMBL	CHEMBL217
IUPHAR	215
DrugBank	BE0000756

Ligand

Name	ondansetron
Molecular formula	C18H19N3O
IUPAC name	9-methyl-3-[(2-methylimidazol-1-yl)methyl]-2,3-dihydro-1H-carbazol-4-one
Molecular weight	293.37
Hydrogen bond acceptor	2
Hydrogen bond donor	0
XlogP	2.3
Synonyms	L000456 9-methyl-3-[(2-methylimidazolyl)methyl]-1,2,3,9-tetrahydro-4aH-carbazol-4-one NCGC00179341-04 AB00373674_18 Ondansetron (JAN/USP/INN) AKOS016340526 Oprea1_852372 BDBM85330 Ratio-ondansetron C18H19N3O SMR001307702 CS-2393 TimTec1_001750 DSSTox_GSID_23393 GR-38032F 1,2,3,9-tetrahydro-9-methyl-3-[(2-methyl-1H-imidazole-1 -yl)methyl]-4H-carbazol-4-one HSDB 8304 ZOFRAN IN PLASTIC CONTAINER I06-1329 9-Methyl-3-((2-methyl-1H-imidazol-1-yl)methyl)-2,3-dihydro-1H-carbazol-4(9H)-one MCULE-9438746800 99614-02-5 Novo-ondansetron AC-28927 Ondansetron Injection BAS 00717177 Prestwick0_001058 BRD-A19736161-001-01-8 SAM002589958 CBDivE_008994 SR-01000763250 D0K7WK Tox21_113048_1 FELGMEQIXOGIFQ-UHFFFAOYSA-N 1,2,3,9,-Tetrahydro-9-methyl-3-[(2-methyl-1H-imidazol-1-yl)methyl]-4H-carbazol-4-one GR38032F 103639-04-9 (mono-hydrochloride dihydrate) Zophren 39O049 KS-00000JSZ 9-methyl-3-[(2-methyl-1H-imidazol-1-yl)methyl]-2,3,4,9-tetrahydro-1H-carbazol-4-one NC00706 AB00373674-15 ACT02589 Ondansetron, (+,-)-Isomer BCP28911 Prestwick3_001058 BSPBio_001016 SC-07554 CHEMBL46 ST2412612 DESMETHYLONDANSETRON GR 38032X 1,2,3,9-tetrahydro-9-methyl-3-[(2-methyl-1H-imidazol-1-yl)methyl]-4H-carbazol-4-one HMS3259H08 Zofran HY-B0002B 9-Methyl-3- (2-methyl-imidazol-1ylmethyl)-1,2,3,9-tetrahydro-carbazol-4-one LS-172305 99614-01-4 NCGC00179341-07 AB00373674_19 ondansetron (Zofran) AN-6592 PHL-ondansetron BPBio1_001118 S-2116 CAS-99614-02-5 SN-307 CTK8G2184 TL8006071 DSSTox_RID_77011 (RS)-1,2,3,9-Tetrahydro-9-methyl-3-(2-methylimidazol-1-ylmethyl)carbazol-4-one GR-38032F/GR-38032 1,2,3,9-tetrahydro-9-methyl-3-[(2-methyl-1H-imidazole-1-yl)methyl]-4H-carbazol-4-one Zofran ODT I544 9-Methyl-3-(2-methyl-imidazol-1-ylmethyl)-1,2,3,9-tetrahydro-carbazol-4-one MLS006011928 AB0013753 NSC_68647 AC1L1IIM Ondansetron [USAN:INN:BAN] BBL010304 Prestwick1_001058 BRD-A19736161-003-03-0 Sandoz ondansetron CHEBI:7773 SR-01000763250-4 FT-0631004 1,2,3,9-Tetrahydro-9-methyl-3-((2-methyl-1H-imidazol-1-yl)methyl)-4H-carbazol-4-one GTPL2290 108303-49-7 VA11441 Zudan 4H-Carbazol-4-one, 1,2,3,9-tetrahydro-9-methyl-3-((2-methyl-1H-imidazol-1-yl)methyl)- KS-5227 9-methyl-3-[(2-methylimidazol-1-yl)methyl]-2,3-dihydro-1H-carbazol-4-one NCGC00179341-02 AB00373674-17 Ondansetron (base and/or unspecified salts) AKOS000599484 Oprea1_435466 BCP9001025 QC-660 C07325 SCHEMBL4542 CPD001307702 STK370548 DSSTox_CID_3393 GR-38032 1,2,3,9-Tetrahydro-9-methyl-3-[(2-methyl-1H-imidazol-1yl)methyl]-4H-carbazol-4-one HMS3371E18 Zofran (TN) I06-0687 9-methyl-3-((2-methyl-1H-imidazol-1-yl)methyl)-1,2,3,9-tetrahydro-4H-carbazol-4-one LS-51878 99614-01-4 (mono-hydrochloride) NCI60_022780 AB2000413 ONDANSETRON HCl Apo-ondansetron PMS-ondansetron BR-29654 s1996 CAS_68647 SPBio_002938 D00456 Tox21_113048 DTXSID8023393 1,2,3,4-Tetrahydro-9-methyl-3-(2-methyl-1H-imidazol-1-ylmethyl)carbazol-4-one GR38032 103639-04-9 Zofran ODT (TN) 116002-70-1 KB-308401 9-methyl-3-[(2-methyl-1H-imidazol-1-yl)methyl]-1,2,3,9-tetrahydro-4H-carbazol-4-one MolPort-001-944-253 AB00373674 Odansetron [common misspelling of ondansetron] ACN-049703 Ondansetron [USP:INN:BAN] BC220610 Prestwick2_001058 BRN 3622981 SBB066158 ST077669 DB00904 GR 38032 1,2,3,9-tetrahydro-9-methyl-3-[(2-methyl-1H-imidazol-1-yl)methyl]-4H- carbazol-4-one HMS2090H16 Z1741971217 Zuplenz [ Show all ]
Inchi Key	FELGMEQIXOGIFQ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C18H19N3O/c1-12-19-9-10-21(12)11-13-7-8-16-17(18(13)22)14-5-3-4-6-15(14)20(16)2/h3-6,9-10,13H,7-8,11H2,1-2H3
PubChem CID	4595
ChEMBL	CHEMBL46
IUPHAR	N/A
BindingDB	85330
DrugBank	DB00904
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	PMID9686407	BindingDB

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