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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

Name	Alpha-1A adrenergic receptor
Species	Rattus norvegicus (Rat)
Gene	Adra1a
Synonym	alpha1c alpha1A-adrenoceptor alpha1a Alpha-1C adrenergic receptor Alpha-1A adrenoreceptor Alpha-1A adrenoceptor alpha-1A adrenergic receptor ADRA1C alpha 1C-adrenergic receptor alpha 1A-adrenoreceptor alpha 1A-adrenoceptor adrenergic receptor, alpha 1a adrenergic receptor alpha 1c adrenergic alpha 1c receptor ADRA1L1 [ Show all ]
Disease	N/A for non-human GPCRs
Length	466
Amino acid sequence	MVLLSENASEGSNCTHPPAPVNISKAILLGVILGGLIIFGVLGNILVILSVACHRHLHSVTHYYIVNLAVADLLLTSTVLPFSAIFEILGYWAFGRVFCNIWAAVDVLCCTASIMGLCIISIDRYIGVSYPLRYPTIVTQRRGVRALLCVWVLSLVISIGPLFGWRQPAPEDETICQINEEPGYVLFSALGSFYVPLAIILVMYCRVYVVAKRESRGLKSGLKTDKSDSEQVTLRIHRKNVPAEGGGVSSAKNKTHFSVRLLKFSREKKAAKTLGIVVGCFVLCWLPFFLVMPIGSFFPDFKPSETVFKIVFWLGYLNSCINPIIYPCSSQEFKKAFQNVLRIQCLRRRQSSKHALGYTLHPPSQALEGQHRDMVRIPVGSGETFYKISKTDGVCEWKFFSSMPQGSARITVPKDQSACTTARVRSKSFLQVCCCVGSSAPRPEENHQVPTIKIHTISLGENGEEV
UniProt	P43140
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	CHEMBL319
IUPHAR	22
DrugBank	N/A

Ligand

Name	(1S,2R)-2-phenylcyclopropanamine
Molecular formula	C9H11N
IUPAC name	(1S,2R)-2-phenylcyclopropan-1-amine
Molecular weight	133.194
Hydrogen bond acceptor	1
Hydrogen bond donor	1
XlogP	1.5
Synonyms	(+)-trans-2-Phenyl-cyclopropyl-amin (1S,2R)-trans-tranylcypromine AC1L1ACF CHEBI:131511 l-Tranylcypromine SCHEMBL145650 (-)-Tranylcypromine 1s,2r-trans-2-phenylcyclopropylamine AKOS027327308 CHEMBL257990 MLS001306494 trans-2-phenylcyclopropan-1-amine (1S,2R)-2-phenylcyclopropan-1-amine BRD-K88809146-003-02-1 CYCLOPROPYLAMINE, 2-PHENYL-, trans- NE64562 UNII-3E3V44J4Z9 component AELCINSCMGFISI-BDAKNGLRSA-N (+)-trans-2-Phenylcyclopropylamine (1S,2R)-tranylcypromine AELCINSCMGFISI-BDAKNGLRSA-N CHEBI:94791 LS-187134 SMR000039637 (1S,2R)-(+)-2-phenylcyclopropylamine 1tnl BDBM50236898 Cyclopropanamine, 2-phenyl-, (1S,2R)- MolPort-002-551-002 trans-2-Phenylcyclopropylamine 8412AH BRD9146 HMS2089B04 R-Tranylcypromine ZINC896663 (+)-Tranylcypromine (1S-trans)-2-Phenylcyclopropanamine AJ-24242 MCULE-4252215835 trans-(-)-2-Phenylcyclopropanamine (1S,2R)-2-Phenyl-cyclopropylamine 3721-28-6 BRD-9146 Cyclopropanamine, 2-phenyl-, trans-(+)- NCGC00179670-01 tranylcypromine [ Show all ]
Inchi Key	AELCINSCMGFISI-BDAKNGLRSA-N
Inchi ID	InChI=1S/C9H11N/c10-9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6,10H2/t8-,9+/m1/s1
PubChem CID	26070
ChEMBL	CHEMBL257990
IUPHAR	N/A
BindingDB	50236898
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	940.0 nM	PMID17827	BindingDB
Ki	7000.0 nM	PMID17827	BindingDB

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