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GLASS

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

Name	G-protein coupled estrogen receptor 1
Species	Homo sapiens (Human)
Gene	GPER1
Synonym	Chemoattractant receptor-like 2 Gpr41 IL8-related receptor DRY12 LERGU LERGU2 LYGPR Lymphocyte-derived G-protein coupled receptor Membrane estrogen receptor mER GPR30 GPGR GPER chemokine receptor-like 2 CMKRL2 DRY12 FEG-1 Flow-induced endothelial G-protein coupled receptor 1 G protein-coupled estrogen receptor 1 G-protein coupled receptor 30 CEPR GPCR-BR [ Show all ]
Disease	N/A
Length	375
Amino acid sequence	MDVTSQARGVGLEMYPGTAQPAAPNTTSPELNLSHPLLGTALANGTGELSEHQQYVIGLFLSCLYTIFLFPIGFVGNILILVVNISFREKMTIPDLYFINLAVADLILVADSLIEVFNLHERYYDIAVLCTFMSLFLQVNMYSSVFFLTWMSFDRYIALARAMRCSLFRTKHHARLSCGLIWMASVSATLVPFTAVHLQHTDEACFCFADVREVQWLEVTLGFIVPFAIIGLCYSLIVRVLVRAHRHRGLRPRRQKALRMILAVVLVFFVCWLPENVFISVHLLQRTQPGAAPCKQSFRHAHPLTGHIVNLAAFSNSCLNPLIYSFLGETFRDKLRLYIEQKTNLPALNRFCHAALKAVIPDSTEQSDVRFSSAV
UniProt	Q99527
Protein Data Bank	N/A
GPCR-HGmod model	Q99527
3D structure model	This predicted structure model is from GPCR-EXP Q99527.
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL5872
IUPHAR	221
DrugBank	BE0003446

Ligand

Name	estradiol valerate
Molecular formula	C23H32O3
IUPAC name	[(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] pentanoate
Molecular weight	356.506
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	6.0
Synonyms	E0876 SMR000058346 Estradiol 17-valerate Valerate d'estradiol [INN-French] Estradiol valerate [USAN:INN:JAN] (1S,11S,14S,15S,10R)-5-hydroxy-15-methyltetracyclo[8.7.0.0<2,7>.0<11,15>]hepta deca-2(7),3,5-trien-14-yl pentanoate Estraval 17\|A-Estradiol-17-valerate GTPL7655 AB0106305 HMS3259C12 BBC/580 MFCD00056541 CHEBI:31561 NSC-17590 Cyclocur Pelanin depot Depo estro med Progynova [(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] pentanoate Ronfase Estate ST075188 Estradiol 17beta-valerate ESTRADIOL, 17-VALERATE 1,3,5(10)-Estratriene-3,17beta-diol 17-pentanote Estroval-10 907-12-0 Gynogen L.A. 40 API0002610 KS-5213 BRD-K66766661-001-19-2 MolPort-002-507-065 component of Deluteval 2X Oestradiol valerate Deladiol Pharlon DSSTox_GSID_23004 Valerato de estradiol SBB080821 Estra-1,3,5(10)-triene-3,17-diol(17beta)-, 17-pentanoate UNII-OKG364O896 Estradiol valerate (JAN/USP/INN) (17.beta.)-Estra-1,3,5(10)-triene-3,17-diol 17-valerate Estradioli valeras 17-BETA-ESTRADIOL 17-VALERATE Femogen-L.A. A845765 Gynokadin B-Estradiol 17-valerate MCULE-6732064308 CCG-221130 Neofollin CPD000058346 Opera_ID_444 Delestrogen Primogyna Dura-estradiol ZINC3881556 EBD28143 SR-01000003061 Estradiol 17.beta.-valerate Estradiol valerate [USP:INN:BAN:JAN] (1S,11S,14S,15S,10R)-5-hydroxy-15-methyltetracyclo[8.7.0.0<2,7>.0<11,15>]hepta deca-2,4,6-trien-14-yl pentanoate Estraval 2X 3-Hydroxy-17beta-valeroyloxyestra-1,3,5(10)-triene Gynogen L.A. 10 AC1L22HN HMS3715B21 BCP11918 MLS000028449 CHEMBL1511 NSC17590 D01413 pentanoate d'estra-1,3,5(10)-tri ne-3-ol-17\|A-yle Depo-Estro-Med Q-201506 RSEPBGGWRJCQGY-RBRWEJTLSA-N Estra-1,3,5(10)-triene-3,17-diol (17-beta)-, 17-pentanoate ST24046695 Estradiol Depot estradiol-17-valerate 124683-EP2295426A1 Exten strone 979-32-8 Gynogen L.A.10 ARONIS24416 LMST02010039 C12859 NC00560 component of Ditate Oestradiol-17b-valerate Deladumone (TN) Postoval DSSTox_RID_76827 Valerato de estradiol [INN-Spanish] Duratrad SCHEMBL40563 Estra-1,5(10)-triene-3,17-diol (17.beta.)-, 17-pentanoate Valerate d'estradiol Estradiol valerate (VAN) (17beta)-3-hydroxyestra-1(10),2,4-trien-17-yl pentanoate Estradioli valeras [INN-Latin] 17-pentanoyl-estra-1,3,5(10)-triene-3,17beta-diol Femogex AB00382980_15 HMS2232L17 B1506 Merimono CCRIS 5571 NSC 17590 CS-2904 Pelanin Delestrogen 4X Progynon-Depot [(8R,9S,13S,14S,17S)-13-methyl-3-oxidanyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] pentanoate EINECS 213-559-2 SR-01000003061-3 Estradiol 17?-valerate Estradiol valerianate (8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-17-yl pentanoate Estraval PA 69557-95-5 Gynogen L.A. 20 AKOS005267158 HY-B0672 beta-Estradiol 17-valerate MLS001146931 Climaval Nuvelle pentanoic acid [(8R,9S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl] ester DSSTox_CID_3004 Repo-Estra s3149 Estra-1,3,5(10)-triene-3,17-diol (17.beta.)-, 17-pentanoate Tox21_111312 Estradiol-17-valerate; 1,3,5(10)-Estratriene-3,17b-diol 17-pentanote 124683-EP2295427A1 Femogen-L.A 979E328 Gynogen LA Atladiol LS-64737 CAS-979-32-8 NCGC00094673-01 component of Mal-O-Fem L.A OKG364O896 Delahormone unimatic Primogyn-Depot DTXSID8023004 Valergen [ Show all ]
Inchi Key	RSEPBGGWRJCQGY-RBRWEJTLSA-N
Inchi ID	InChI=1S/C23H32O3/c1-3-4-5-22(25)26-21-11-10-20-19-8-6-15-14-16(24)7-9-17(15)18(19)12-13-23(20,21)2/h7,9,14,18-21,24H,3-6,8,10-13H2,1-2H3/t18-,19-,20+,21+,23+/m1/s1
PubChem CID	13791
ChEMBL	N/A
IUPHAR	N/A
BindingDB	N/A
DrugBank	DB13956
Structure SDF download
Lipinski's druglikeness	This ligand has a partition coefficient log P greater than 5.

Experimental Data

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

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