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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	D(2) dopamine receptor
Species	Rattus norvegicus (Rat)
Gene	Drd2
Synonym	D2 receptor D2(415) and D₂₍₄₄₄₎ D2A and D_2B D2R Dopamine D2 receptor dopamine receptor 2 [ Show all ]
Disease	N/A for non-human GPCRs
Length	444
Amino acid sequence	MDPLNLSWYDDDLERQNWSRPFNGSEGKADRPHYNYYAMLLTLLIFIIVFGNVLVCMAVSREKALQTTTNYLIVSLAVADLLVATLVMPWVVYLEVVGEWKFSRIHCDIFVTLDVMMCTASILNLCAISIDRYTAVAMPMLYNTRYSSKRRVTVMIAIVWVLSFTISCPLLFGLNNTDQNECIIANPAFVVYSSIVSFYVPFIVTLLVYIKIYIVLRKRRKRVNTKRSSRAFRANLKTPLKGNCTHPEDMKLCTVIMKSNGSFPVNRRRMDAARRAQELEMEMLSSTSPPERTRYSPIPPSHHQLTLPDPSHHGLHSNPDSPAKPEKNGHAKIVNPRIAKFFEIQTMPNGKTRTSLKTMSRRKLSQQKEKKATQMLAIVLGVFIICWLPFFITHILNIHCDCNIPPVLYSAFTWLGYVNSAVNPIIYTTFNIEFRKAFMKILHC
UniProt	P61169
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	CHEMBL339
IUPHAR	215
DrugBank	N/A

Ligand

Name	CHEMBL88365
Molecular formula	C17H20N2O
IUPAC name	3-(4-benzylpiperazin-1-yl)phenol
Molecular weight	268.36
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	3.0
Synonyms	SCHEMBL13902706 ZINC26638652 1-benzyl-4-(3-hydroxyphenyl)piperazine BDBM50069907 D04PBA 3-(4-Benzyl-piperazin-1-yl)-phenol [ Show all ]
Inchi Key	BISVFNHMXVNVMG-UHFFFAOYSA-N
Inchi ID	InChI=1S/C17H20N2O/c20-17-8-4-7-16(13-17)19-11-9-18(10-12-19)14-15-5-2-1-3-6-15/h1-8,13,20H,9-12,14H2
PubChem CID	10015867
ChEMBL	CHEMBL88365
IUPHAR	N/A
BindingDB	50069907
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	5.5 nM	PMID9871673, PMID9873601, Med Chem Res, (2013) 22:2:520	BindingDB,ChEMBL
Ki	95.0 nM	PMID9871673, PMID9873601	BindingDB
Ki	95.1 nM	PMID9871673, PMID9873601, Med Chem Res, (2013) 22:2:520	ChEMBL
Ki	246.0 nM	Med Chem Res, (2013) 22:2:520	ChEMBL

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