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GLASS

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GPCR

Name	D(4) dopamine receptor
Species	Rattus norvegicus (Rat)
Gene	Drd4
Synonym	D(2C) dopamine receptor D4 receptor D4R Dopamine D4 receptor dopamine receptor 4
Disease	N/A for non-human GPCRs
Length	387
Amino acid sequence	MGNSSATGDGGLLAGRGPESLGTGTGLGGAGAAALVGGVLLIGMVLAGNSLVCVSVASERILQTPTNYFIVSLAAADLLLAVLVLPLFVYSEVQGGVWLLSPRLCDTLMAMDVMLCTASIFNLCAISVDRFVAVTVPLRYNQQGQCQLLLIAATWLLSAAVAAPVVCGLNDVPGRDPTVCCLEDRDYVVYSSICSFFLPCPLMLLLYWATFRGLRRWEAARHTKLHSRAPRRPSGPGPPVSDPTQGPLFSDCPPPSPSLRTSPTVSSRPESDLSQSPCSPGCLLPDAALAQPPAPSSRRKRGAKITGRERKAMRVLPVVVGAFLMCWTPFFVVHITRALCPACFVSPRLVSAVTWLGYVNSALNPIIYTIFNAEFRSVFRKTLRLRC
UniProt	P30729
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	CHEMBL3361
IUPHAR	217
DrugBank	N/A

Ligand

Name	Aripiprazole
Molecular formula	C23H27Cl2N3O2
IUPAC name	7-[4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy]-3,4-dihydro-1H-quinolin-2-one
Molecular weight	448.388
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	4.6
Synonyms	129722-12-9 Abilify Abilitat Abilify Discmelt OPC-14597 Discmelt aripiprazol Opc 14597 OPC 31 Aripiprazole [USAN] aripiprazolum Aripirazole OPC-31 Abilify (TN) 7-[4-[4-(2,3-Dichlorophenyl)-1-piperazinyl]butoxy]-3,4-dihydrocarbostyril UNII-82VFR53I78 C23H27Cl2N3O2 HSDB 7320 7-(4-(4-(2,3-DICHLOROPHENYL)PIPERAZIN-1-YL)BUTOXY)-3,4-DIHYDROQUINOLIN-2(1H)-ONE CHEMBL1112 7-(4-(4-(2,3-Dichlorophenyl)-1-piperazinyl)butyloxy)-3,4-dihydro-2(1H)-quinolinone 7-{4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy}-1,2,3,4-tetrahydroquinolin-2-one Aripiprazole (JAN/USAN/INN) ALKS-9070 CHEBI:31236 CEUORZQYGODEFX-UHFFFAOYSA-N 82VFR53I78 7-(4-(4-(2,3-Dichlorophenyl)-1-piperazinyl)butoxy)-3,4-dihydrocarbostyril 2(1H)-Quinolinone, 7-[4-[4-(2,3-dichlorophenyl)-1-piperazinyl]butoxy]-3,4-dihydro- 7-(4-(4-(2,3-Dichlorophenyl)-1-piperazinyl)butoxy)-3,4-dihydro-2(1H)-quinolinone 7-[4-[4-(2,3-Dichlorophenyl)-1-piperazinyl]butoxy]-3,4-dihydro-2(1H)-quinolinone 7-[4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy]-3,4-dihydro-1H-quinolin-2-one 7-{4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy}-3,4-dihydroquinolin-2(1H)-one BMS-337039 KS-1030 NCGC00159510-02 CPD000466383 DSSTox_CID_26083 DSSTox_RID_81324 DSSTox_GSID_46083 S06-0010 Pripiprazole Arpizol Abilify Maintena 2(1H)-Quinolinone, 7-(4-(4-(2,3-dichlorophenyl)-1-piperazinyl)butoxy)-3,4-dihydro- SMR000466383 Abilify Maintena Kit CAS-129722-12-9 SR-01000759353 Aripiprex Asprito Aripiprazole; Abilify Digital Abilify MyCite Aripiprazole [USAN:INN:BAN] Aripiprazole D8 7-(4-[4-(2,3-dichlorophenyl)-1-piperazinyl]butoxy)-3,4-dihydrocarbostyril 7-{4-[4-(2,3-dichlorophenyl)-1-piperazinyl]butoxy}-3,4-dihydrocarbostyril Abilify OD 7-(4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy)-3,4-dihydroquinolin-2(1H)-one Aripiprazole Depot Discmelt (TN) ACMC-20emtv Aripiprazole (Abilify) PubChem18143 AC1L1TXZ D0H3HM D0P8CI D0Y2GK GTPL34 SCHEMBL8255 Otsuka brand of aripiprazole MLS000759517 MLS001165779 MLS001195621 MLS001424078 MLS006011892 AC1Q3T38 SCHEMBL5335696 Aristada (aripiprazole lauroxil) DTXSID3046083 SCHEMBL12961254 ALKS-9072 CTK0H5518 AOB5922 ALKS9070/ALKS9072 MolPort-002-885-808 HMS2051I18 HMS2089M20 HMS2093F22 HMS2230M18 HMS3373D04 HMS3393I18 HMS3657K13 HMS3715J07 Pharmakon1600-01505851 ACT03221 BCP04902 EBD20357 KS-00000XK7 ZINC1851149 Tox21_111728 AN-902 BBL029082 BDBM50130293 CA0141 DL-178 FC0025 NSC759266 s1975 STK625160 AKOS005558247 OPC 14597; OPC 31 Tox21_111728_1 AB07660 AC-1554 BCP9000317 CCG-100891 CS-0766 DB01238 MCULE-4329329262 NC00141 NSC-759266 RTR-004086 Aripiprazole 1.0 mg/ml in Acetonitrile NCGC00159510-03 NCGC00159510-04 NCGC00159510-05 AJ-32089 AK-46736 BC208491 BR-46736 HY-14546 KB-47438 SAM001246750 SC-16317 Bristol-Myers Squibb brand of aripiprazole SBI-0206870.P001 AB0008434 AB1006698 LS-142666 ST2412627 TL8000707 AM20090766 FT-0082572 FT-0600352 SW197521-3 TL80090184 4811-EP2269990A1 4811-EP2272841A1 4811-EP2298731A1 4811-EP2298776A1 4811-EP2301936A1 A19454 Aripiprazole/escitalopram fixed-dose combination C12564 D01164 J10066 S-4507 AB00639935-09 AB00639935_10 AB00639935_11 722A129 L001339 J-005707 SR-01000759353-4 SR-01000759353-6 BRD-K70358946-001-06-6 Z1541632800 7-[4-(4-(2,3-Dichlorophenyl)piperazin-1-yl)butoxy]-3,4-dihydro-2(1H)-quinolinone 7-[4-[4-(2,3-Dichlorophenyl)-1-Piperazinyl]Butoxy]3,4-Dihydro-2(1H)-Quinolinone 7-[4-[4-(2,3-dichlorophenyl)piperazin-1-yl]butoxy]-3,4-dihydro-quinolin-2(1H)-one 7-[4-[4-[2,3-bis(chloranyl)phenyl]piperazin-1-yl]butoxy]-3,4-dihydro-1H-quinolin-2-one 7-{4-[-4-(2,3-dichlorophenyl)-1-piperazinyl]butoxy}-3,4-dihydrocarbostyril 7-{4-[4-(2,3-dichlorophenyl)-1-piperazinyl]butoxy}-3, 4-dihydrocarbostyril 7-{4-[4-(2,3-dichlorophenyl)piperazino]butoxy}-3,4-dihydro-2(1H)-quinolinone 24-29-3 7-[4-[4-(2,3-Dichlorophenyl)-1-piperazinyl]butoxy]-3,4-dihydrocarbostyril; 7-{4-[4-(2,3-Dichlorophenyl)piperazin-1-yl]butoxy}-3,4-dihydroquinolin-2(1H)-one 9SC Aripiprazole solution, 1.0 mg/mL (50:50 Methanol/Water with 1% 1N HCl), ampule of 1 mL, certified reference material Aripiprazole solution, 1.0 mg/mL in acetonitrile, ampule of 1 mL, certified reference material [ Show all ]
Inchi Key	CEUORZQYGODEFX-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H27Cl2N3O2/c24-19-4-3-5-21(23(19)25)28-13-11-27(12-14-28)10-1-2-15-30-18-8-6-17-7-9-22(29)26-20(17)16-18/h3-6,8,16H,1-2,7,9-15H2,(H,26,29)
PubChem CID	60795
ChEMBL	CHEMBL1112
IUPHAR	34
BindingDB	50130293
DrugBank	DB01238
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Ki	50.1187 nM	PMID10617689	IUPHAR
Ki	260.0 nM	PMID10327430	BindingDB
Ki	510.0 nM	PMID12784105, PMID27312422	BindingDB,ChEMBL

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