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GPCR

Name	Alpha-2B adrenergic receptor
Species	Homo sapiens (Human)
Gene	ADRA2B
Synonym	alpha2-C2 alpha2B alpha2B-adrenoceptor Alpha-2BAR alpha-2B adrenoreceptor Alpha-2B adrenoceptor alpha-2B adrenergic receptor Alpha-2 adrenergic receptor subtype C2 adrenergic receptor Adrenergic alpha2B- receptor class III ADRA2RL1 ADRA2L1 Adra-2b [ Show all ]
Disease	Neuropathic pain Alcohol use disorders
Length	450
Amino acid sequence	MDHQDPYSVQATAAIAAAITFLILFTIFGNALVILAVLTSRSLRAPQNLFLVSLAAADILVATLIIPFSLANELLGYWYFRRTWCEVYLALDVLFCTSSIVHLCAISLDRYWAVSRALEYNSKRTPRRIKCIILTVWLIAAVISLPPLIYKGDQGPQPRGRPQCKLNQEAWYILASSIGSFFAPCLIMILVYLRIYLIAKRSNRRGPRAKGGPGQGESKQPRPDHGGALASAKLPALASVASAREVNGHSKSTGEKEEGETPEDTGTRALPPSWAALPNSGQGQKEGVCGASPEDEAEEEEEEEEEEEECEPQAVPVSPASACSPPLQQPQGSRVLATLRGQVLLGRGVGAIGGQWWRRRAQLTREKRFTFVLAVVIGVFVLCWFPFFFSYSLGAICPKHCKVPHGLFQFFFWIGYCNSSLNPVIYTIFNQDFRRAFRRILCRPWTQTAW
UniProt	P18089
Protein Data Bank	N/A
GPCR-HGmod model	P18089
3D structure model	This predicted structure model is from GPCR-EXP P18089.
BioLiP	N/A
Therapeutic Target Database	T41580
ChEMBL	CHEMBL1942
IUPHAR	26
DrugBank	BE0000572

Ligand

Name	fenoldopam
Molecular formula	C16H16ClNO3
IUPAC name	9-chloro-5-(4-hydroxyphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol
Molecular weight	305.758
Hydrogen bond acceptor	4
Hydrogen bond donor	4
XlogP	2.4
Synonyms	CHEBI:5002 D0R6BI Fenodopam mesylate HMS2090G16 MLS001401388 NCGC00025246-03 67227-56-9 SK-82526-J TVURRHSHRRELCG-UHFFFAOYSA-N AKOS015906543 BRD-A50684349-003-01-1 cid_49659 DSSTox_CID_23896 Fenoldopam [INN:BAN] I745 NCGC00015444-04 SCHEMBL13287212 87900-90-1 SKF-82526 AB00698256-15 BC220528 Carlacor CS-2979 DTXSID0043896 FT-0641107 LS-27993 NCGC00015444-07 6-chloro-1-(4-hydroxyphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol SK&F-82526J 9-chloro-5-(4-hydroxyphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol;mesylic acid Tox21_110152 AC1L1FPQ BPBio1_001265 CC-28388 HMS3715H14 MolPort-006-167-637 PDSP1_001661 67227-57-0 (mesylate) SKF 82526 AB0013872 VA10891 AN-38412 C-20379 Corlopam DSSTox_GSID_43896 Fenoldopamum L000254 NCGC00015444-05 1H-3-Benzazepine-7,8-diol, 6-chloro-2,3,4,5-tetrahydro-1-(4-hydroxyphenyl)- SCHEMBL34250 9-chloranyl-5-(4-hydroxyphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol;methanesulfonic acid SKF-82526J AB00698256_16 BDBM60917 Carlacor (TN) D07946 EN300-119508 GTPL939 MCULE-7876003953 NCGC00025246-02 SK-82526 9-chloro-5-(4-hydroxyphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol;methanesulfonic acid Tox21_110152_1 AC1Q3LHG BRD-A50684349-001-01-5 CCG-204646 CHEMBL588 DB00800 Fenoldopam (INN) HY-B0735 NCGC00015444-03 (R)-6-Chloro-2,3,4,5-tetrahydro-1-(4-hydroxyphenyl)-1H-3-benzazepine-7,8-diol PDSP2_001645 67287-54-1 (hydrobromide) SKF 82526-J AB00698256-13 API0007253 C07693 Corlopam (TN) DSSTox_RID_80083 Fenoldopamum [Latin] Lopac0_000556 NCGC00015444-06 27F569 SK&F-82526 9-chloro-5-(4-hydroxyphenyl)-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol SMR000469190 AB2000493 Biomol-NT_000042 CAS-67227-56-9 [ Show all ]
Inchi Key	TVURRHSHRRELCG-UHFFFAOYSA-N
Inchi ID	InChI=1S/C16H16ClNO3/c17-15-11-5-6-18-8-13(9-1-3-10(19)4-2-9)12(11)7-14(20)16(15)21/h1-4,7,13,18-21H,5-6,8H2
PubChem CID	3341
ChEMBL	CHEMBL588
IUPHAR	939
BindingDB	60917
DrugBank	DB00800
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
	N/A	N/A	DrugBank

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