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GPCR

Name	Olfactory receptor 5K1
Species	Homo sapiens (Human)
Gene	OR5K1
Synonym	HTPCRX10 Olfactory receptor OR3-8
Disease	N/A
Length	308
Amino acid sequence	MAEENHTMKNEFILTGFTDHPELKTLLFVVFFAIYLITVVGNISLVALIFTHRRLHTPMYIFLGNLALVDSCCACAITPKMLENFFSENKRISLYECAVQFYFLCTVETADCFLLAAMAYDRYVAICNPLQYHIMMSKKLCIQMTTGAFIAGNLHSMIHVGLVFRLVFCGSNHINHFYCDILPLYRLSCVDPYINELVLFIFSGSVQVFTIGSVLISYLYILLTIFKMKSKEGRAKAFSTCASHFLSVSLFYGSLFFMYVRPNLLEEGDKDIPAAILFTIVVPLLNPFIYSLRNREVISVLRKILMKK
UniProt	Q8NHB7
Protein Data Bank	N/A
GPCR-HGmod model	Q8NHB7
3D structure model	This predicted structure model is from GPCR-EXP Q8NHB7.
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL3721312
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	Citral
Molecular formula	C10H16O
IUPAC name	(2E)-3,7-dimethylocta-2,6-dienal
Molecular weight	152.237
Hydrogen bond acceptor	1
Hydrogen bond donor	0
XlogP	3.0
Synonyms	RP21648 CCRIS 1043 STK802499 cis/trans Citral; WTEVQBCEXWBHNA-JXMROGBWSA-N CITRAL SINTETICO (2E)-3,7-dimethyl-octa-2,6-dienal Citral-A (Z)-3,7-Dimethyl-2,6-octadienal EINECS 205-476-5 2,6-Octadienal,3,7-dimethyl-, reaction products with Et alc. geranal 3,7-Dimethyl-2,6-octadienal KB-234385 5392-40-5 LS41486 AI3-01011 NCGC00091550-04 AS-35309 BRN 1721871 SBB060834 CHEBI:23316 trans-3,7-Dimethyl-2,6-octadienal Citral (natural) Citral, analytical standard (E)-3,7-Dimethyl-2,6-octadienal CJ-23866 141-27-5 F0001-1403 3,6-octadienal geranialdehyde 3,7-dimethylocta-2,6-dienal lemonal 96680-15-8 MolPort-003-909-614 AKOS000119519 NSC-6170 Z-Citral polyprenals C15604 ST24028249 cis,trans-Citral UNII-T7EU0O9VPP component WTEVQBCEXWBHNA-JXMROGBWSA-N Citral Ex Litsea(Citral ) (2E)-3,7-dimethyl-2,6-octadien-1-al Citral, natural, >=96%, FCC, FG (E)-Geranial EC 205-476-5 2,6-Octadienal, 3,7-dimethyl-, (2E)- FEMA Number 2303 3,7-dimethyl-(e)-2,6-octadienal HSDB 993 4-01-00-03569 (Beilstein Handbook Reference) LMPR0102010003 AC1Q1NUZ NCGC00091550-02 AN-21095 BBL011666 RTR-037028 CHEBI:137934 TL8003535 cis/trans-3,7-Dimethyl-2,6-octadienal Citral, 95% (2E)-3,7-dimethylocta-2,6-dienal citral-b .alpha.-Citral EINECS 226-394-6 250599-19-0 Geranaldehyde 3,7-DIMETHYL-2,6-OCTADIENAL(TRANS) LEMAROME 758ZMW724E MFCD00006997 AI3-28519 NCI-C56348 BRN 1721873 SC-26888 trans-Citral Citral a Citral, mixture of cis and trans (E)-3,7-Dimethylocta-2,6-dienal D00VWN 147060-73-9 FEMA 2303 3,7- dimethylocta-2,6-dienal GRQ 3-01-00-03053 (Beilstein Handbook Reference) Lemsyn GB A829835 Natural Citral alpha -Citral NSC6170 ZINC1529208 Q-200867 Caswell No. 221B ST50308094 cis-3,7-Dimethyl-2,6-octadienal WLN: VH1UY1&3Y1&U1 CITRAL NATURAL (2E)-3,7-Dimethyl-2,6-octadienal Citral, Vetec(TM) reagent grade, 94% (E)-Neral EC 226-394-6 2,6-Octadienal, 3,7-dimethyl-, (E)- Genanial 3,7-Dimethyl-1,2,6-octadienal InChI=1/C10H16O/c1-9(2)5-4-6-10(3)7-8-11/h5,7-8H,4,6H2,1-3H3/b10-7 433282-33-8 LS-97778 AC1Q6POW NCGC00091550-03 AN-23205 beta-Geranial S14-1149 CHEBI:16980 TR-037028 Citral, 95%, mixture of cis and trans (2Z)-3,7-Dimethyl-2,6-octadienal CJ-05166 1392408-16-0 EPA Pesticide Chemical Code 040510 3,2,6-octadienal GERANIAL 3,7-Dimethyl-trans-2,6-octadienal Lemarome n 8022-94-4 MolPort-001-783-112 AJ-26578 NSC 6170 polyprenal C01499 SCHEMBL23073 CHEMBL1080997 UNII-758ZMW724E Citral alpha Citral, mixture of cis and trans, >=96%, FG (E)-Citral EBD2204555 2,6-Dimethyloctadien-2,6-al-8 FEMA No. 2303 3,7-dimethyl-(2e)-2,6-octadienal GTPL6327 37350-34-8 litsea cubeba oil terpeneless AC1LCVGF NCGC00091550-01 alpha-Citral [ Show all ]
Inchi Key	WTEVQBCEXWBHNA-JXMROGBWSA-N
Inchi ID	InChI=1S/C10H16O/c1-9(2)5-4-6-10(3)7-8-11/h5,7-8H,4,6H2,1-3H3/b10-7+
PubChem CID	638011
ChEMBL	CHEMBL1080997
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Inhibition	75.0 %	None	ChEMBL

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