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GPCR

Name	Neuromedin-U receptor 2
Species	Homo sapiens (Human)
Gene	NMUR2
Synonym	G-protein coupled receptor FM-4 G-protein coupled receptor TGR-1 FM4 NMU-R2 NMU2 receptor FM-4 SNORF72 TGR-1 [ Show all ]
Disease	N/A
Length	415
Amino acid sequence	MSGMEKLQNASWIYQQKLEDPFQKHLNSTEEYLAFLCGPRRSHFFLPVSVVYVPIFVVGVIGNVLVCLVILQHQAMKTPTNYYLFSLAVSDLLVLLLGMPLEVYEMWRNYPFLFGPVGCYFKTALFETVCFASILSITTVSVERYVAILHPFRAKLQSTRRRALRILGIVWGFSVLFSLPNTSIHGIKFHYFPNGSLVPGSATCTVIKPMWIYNFIIQVTSFLFYLLPMTVISVLYYLMALRLKKDKSLEADEGNANIQRPCRKSVNKMLFVLVLVFAICWAPFHIDRLFFSFVEEWSESLAAVFNLVHVVSGVFFYLSSAVNPIIYNLLSRRFQAAFQNVISSFHKQWHSQHDPQLPPAQRNIFLTECHFVELTEDIGPQFPCQSSMHNSHLPAALSSEQMSRTNYQSFHFNKT
UniProt	Q9GZQ4
Protein Data Bank	N/A
GPCR-HGmod model	Q9GZQ4
3D structure model	This predicted structure model is from GPCR-EXP Q9GZQ4.
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL1075144
IUPHAR	299
DrugBank	N/A

Ligand

Name	Synephrine
Molecular formula	C9H13NO2
IUPAC name	4-[1-hydroxy-2-(methylamino)ethyl]phenol
Molecular weight	167.208
Hydrogen bond acceptor	3
Hydrogen bond donor	3
XlogP	-0.6
Synonyms	DB09203 (+/-)-Synephrine, >=98% p-Hydroxy-.alpha.-[(methylamino)methyl]benzyl alcohol EU-0101085 1-(4-Hydroxyphenyl)-(2-methylamino)ethanol p-Synephrine HMS3263I12 4-Hydroxy-.alpha.-((methylamino)methyl)benzenemethanol Pharmakon1600-01506085 I06-0007 582-84-3 S 38537-9 LS-43029 AC1Q412W Simpalon NC00348 API0024621 ST095769 NCGC00015924-13 Benzenemethanol, 4-hydroxy-alpha-((methylamino)methyl)-, (S)- Synefrin [Czech] NSC 170956 BPBio1_001250 T5534 Oxedrine ((-)-) CHEBI:29081 YRCWQPVGYLYSOX-UHFFFAOYSA-N DSSTox_GSID_30588 (.+/-.)-Synephrine p-Hydroxy-alpha-[(methylamino)methyl]benzyl alcohol FT-0653012 1-(4-Hydroxyphenyl)-2-(methylamino)ethanol Parakorper [German] HMS3394G09 4-Hydroxy-alpha-(methylaminomethyl)benzyl alcohol Prestwick2_001088 l-Sympatol 94S075 SAM001246896 Methylaminomethyl(4-hydroxyphenyl)carbinol AKOS016038542 SPBio_003028 NCGC00015924-05 BDBM50102660 Sympaethamin NCGC00089788-03 BENZYL ALCOHOL, p-HYDROXY-alpha-((METHYLAMINO)METHYL)- Synephrine (Oxedrine) NSC-759316 C04548 Tox21_200962 Oxedrine [INN:BAN] CPD000059111 ((Methylamino)methyl)((4-hydroxyphenyl)carbinol) (+-)-N-Methyloctopamine Oxedrine\|\|\|4-Hydroxy-a-[(methylamino)methyl]-benzenemethanol EINECS 202-300-9 (y)-Synephrine p-Methylaminoethanolphenol HMS2098I18 1-[4-Hydroxyphenyl]-2-methylaminoethanol PDSP2_000166 I01-2279 4-[1-Hydroxy-2-(methylamino)ethyl]phenol # RP23020 LP01085 AB00514040 SC-46736 MolPort-000-787-358 alpha-(4-Oxyphenyl)alpha-oxy-beta-methylaminoaethan [German] SR-01000002983-7 NCGC00015924-09 Benzenemethanol, 4-hydroxy-alpha-((methylamino)methyl)- (9CI) Sympatol NCGC00261770-01 beta-Methylamino-alpha-(4-hydroxyphenyl)ethyl alcohol Synephrine,(S) NSC759316 CCG-101098 W-100214 D07148 DL-SYNEPHRINE (+/-)synephrine p-Hydroxy-.alpha.-[(methylamino)methyl]benzylalcohol FCH1116446 1-(4-Hydroxyphenyl)-(N-methylethanol)amine p-[(Methylamino)ethanol]phenol HMS3264E11 4-Hydroxy-a-(methylaminomethyl)benzyl alcohol Prestwick0_001088 K712 7336264B-EDC9-42C5-939B-FF800AB5BB4A S0232 LS-43031 AK141733 Simpatol NCGC00015924-03 AX8011379 STK803113 NCGC00016351-01 benzenemethanol, 4-hydroxy-alpha-[(methylamino)methyl]-, 2,3-dihydroxybutanedioate (1:1) (salt) Synephrin NSC-166285 BSPBio_001136 Tox21_110390 Oxedrine (BAN) ZX-AN024253 ( inverted exclamation markA)-Synephrine (+)-[(methylamino)methyl]-Benzenemethano DSSTox_RID_78850 (?)-Synephrine p-Hydroxyphenyl(methylamino)ethanol HMS1571I18 1-(4-Hydroxyphenyl)-2-methylaminoethanol Parasympatol HMS3656O09 4-hydroxy-alpha-[(methylamino)methyl]benzenemethanol Prestwick3_001088 l-Synephrine AB0014348 SBB063601 MLS000069435 ALBB-025740 SR-01000002983 NCGC00015924-06 Benzenemethanol, 4-hydroxy-.alpha.-[(methylamino)methyl]- Sympaethamine NCGC00089788-04 BENZYL ALCOHOL, p-HYDROXY-alpha-((METHYLAMINO)METHYL)-, (+)- Synephrine - Oxedrine NSC166285 CAS-94-07-5 Tox21_501085 CS0043 (+/-)-Synephrine p-((Methylamino)ethanol)phenol Ethaphene .beta.-Methylamino-.alpha.-(4-hydroxyphenyl)ethyl alcohol p-Oxedrine HMS2233F20 4-(1-Hydroxy-2-(methylamino)ethyl)phenol Pentedrin [German] I01-8196 S 0752 LS-43028 AC1L1O67 SCHEMBL146500 N1706 Analeptin SR-01000002983-8 NCGC00015924-12 Benzenemethanol, 4-hydroxy-alpha-((methylamino)methyl)-, (-)- Synefrin NSC 166285 BP-12742 Synthenate Oxedrine CCG-205162 WLN: QR DYQ1M1 DSSTox_CID_10588 (.+/-.)-N-Methyloctopamine p-Hydroxy-alpha-((methylamino)methyl)benzyl alcohol FT-0618685 1-(4-hydroxyphenyl)-2-(methylamino)ethan-1-ol Parakorper HMS3369C13 4-Hydroxy-alpha-((methylamino)methyl)benzenemethanol Prestwick1_001088 KS-5152 94-07-5 s2362 MCULE-4991429316 AKOS004119915 SMR000059111 NCGC00015924-04 BBL015111 SW197214-5 NCGC00089788-02 Benzyl alcohol, p-hydroxy-.alpha.-[(methylamino)methyl]- NSC-170956 C-33457 Tox21_110390_1 Oxedrine [BAN] CHEMBL33720 [(Methylamino)methyl][(4-hydroxyphenyl)carbinol] ( inverted question mark)-Synephrine (+,-)-Synephrine Oxedrine, p-Synephrine, Sympatol, Parasympatol, Sympaethamine, 34520 DTXSID0030588 (RS)-1-(4-Hydroxyphenyl)-2-(methylamino)ethanol p-Hydroxyphenylmethylaminoethanol HMS2052G09 1-(4-Hydroxyphenyl)-N-methylethanolamine PDSP1_000167 HMS3715I18 4-[1-Hydroxy-2-(methylamino)ethyl]phenol Q-100668 Lopac0_001085 AB00384265_11 SBI-0051055.P002 MLS001424216 alpha-(4-Oxyphenyl)alpha-oxy-beta-methylaminoaethan SR-01000002983-3 NCGC00015924-08 Benzenemethanol, 4-hydroxy-alpha-((methylamino)methyl)- Sympathol NCGC00258515-01 BENZYL ALCOHOL, p-HYDROXY-alpha-((METHYLAMINO)METHYL)-, (-)- Synephrine, analytical standard NSC170956 CC-34623 TR-038493 CTK2F4574 [ Show all ]
Inchi Key	YRCWQPVGYLYSOX-UHFFFAOYSA-N
Inchi ID	InChI=1S/C9H13NO2/c1-10-6-9(12)7-2-4-8(11)5-3-7/h2-5,9-12H,6H2,1H3
PubChem CID	7172
ChEMBL	CHEMBL33720
IUPHAR	N/A
BindingDB	50102660
DrugBank	DB09203
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
EC50	6600.0 nM	PMID25262941	BindingDB,ChEMBL

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