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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP TM-fold DECOYS POTENTIAL RW/RWplus HPSF THE-DB CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13

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GPCR

NameAdenosine receptor A1
SpeciesRattus norvegicus (Rat)
GeneAdora1
SynonymA1R
A1 receptor
adenosine receptor A1
A1-AR
RDC7
DiseaseN/A for non-human GPCRs
Length326
Amino acid sequenceMPPYISAFQAAYIGIEVLIALVSVPGNVLVIWAVKVNQALRDATFCFIVSLAVADVAVGALVIPLAILINIGPQTYFHTCLMVACPVLILTQSSILALLAIAVDRYLRVKIPLRYKTVVTQRRAAVAIAGCWILSLVVGLTPMFGWNNLSVVEQDWRANGSVGEPVIKCEFEKVISMEYMVYFNFFVWVLPPLLLMVLIYLEVFYLIRKQLNKKVSASSGDPQKYYGKELKIAKSLALILFLFALSWLPLHILNCITLFCPTCQKPSILIYIAIFLTHGNSAMNPIVYAFRIHKFRVTFLKIWNDHFRCQPKPPIDEDLPEEKAED
UniProtP25099
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL318
IUPHAR18
DrugBankN/A

Known ligands

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Total entries: 3633
Page:  / 37 

GLASS IDMoleculeFormulaMolecular weightH-bond acceptor / donorXlogPLipinski's druglikeness
5214442D structureCHEMBL3735468C15H12ClN3O285.7314 / 13.3Yes
3532D structureCHEMBL38811C15H15N3O2269.3042 / 01.5Yes
4792D structureCHEMBL38304C28H32N6O4516.6026 / 23.2No
5352D structureCHEMBL338501C21H14Cl2N4393.2713 / 15.0Yes
6092D structureCHEMBL17202C28H29N5O4499.5715 / 25.5No
6122D structureCID 53633248C28H29N5O4499.5715 / 25.5No
6542D structureCHEMBL323403C24H23NO3S405.5125 / 05.9No
7352D structureCHEMBL315101C13H17N5243.3144 / 23.1Yes
5214672D structureCHEMBL3827623C26H36N6O3480.6136 / 03.9Yes
8212D structureCHEMBL72117C15H18N4O2286.3353 / 12.2Yes
8982D structureCHEMBL72007C19H20N4O320.3963 / 24.1Yes
11432D structureCHEMBL307307C14H15N5253.3094 / 02.9Yes
11742D structureCHEMBL319971C17H14ClN5O2355.7825 / 13.2Yes
12712D structureCHEMBL420368C14H11ClF5N5379.7199 / 14.9Yes
13182D structureCHEMBL319356C9H12N4176.2233 / 21.5Yes
13342D structureMRS-1042C24H28O5396.4835 / 06.0No
14202D structure8-PhenylxanthineC11H8N4O2228.2113 / 30.9Yes
15012D structureCHEMBL610601C30H31N7O6585.6219 / 52.3No
18162D structureCHEMBL603861C21H20F2N4O4430.4127 / 02.2Yes
19302D structure2-(3-Cyclopentyl-1-propynyl)adenosineC18H23N5O4373.4138 / 41.8Yes
21792D structureCHEMBL343527C18H14N4O4350.3345 / 11.8Yes
29612D structureCHEMBL367705C13H13N5O255.2814 / 20.7Yes
31092D structureCHEMBL607881C15H20IN5O4461.268 / 41.6Yes
31832D structureCHEMBL72953C14H15F2N5291.3066 / 13.7Yes
33232D structureCHEMBL3093226C21H27N5O3397.4795 / 02.7Yes
34342D structureCHEMBL2113345C17H18N4O4342.3555 / 31.8Yes
36112D structureCHEMBL325664C19H23N5O337.4275 / 13.5Yes
38602D structure316173-57-6C20H19N7O2389.4197 / 12.7Yes
41392D structureCHEMBL603991C19H24N6O4400.4399 / 51.7Yes
42692D structureBDBM50052395C14H21NO5283.3246 / 00.8Yes
44872D structureCHEMBL610386C13H19N5O5325.3259 / 5-0.2Yes
45182D structureCHEMBL70059C27H40N8O5556.6688 / 52.2No
45192D structureCHEMBL553037C27H40N8O5556.6688 / 52.2No
45882D structureCHEMBL79201C14H14N6OS314.3676 / 21.2Yes
47482D structureCHEMBL27376C20H20ClIN6O3554.7737 / 42.0No
50052D structureCHEMBL1790736C16H22ClN5O3367.8347 / 33.3Yes
51562D structureCHEMBL1095693C12H12N2OS232.3013 / 01.8Yes
52662D structureCHEMBL164039C24H29NO4S2459.6197 / 05.6No
53732D structureCHEMBL3093315C17H17N5O2S355.4165 / 01.4Yes
56312D structure2-(1-hexynyl)adenosineC16H21N5O4347.3758 / 41.3Yes
56582D structureFR-166124C25H22N4O3426.4765 / 12.9Yes
58012D structureCHEMBL392115C19H23N5O3369.4255 / 11.4Yes
5216342D structureCHEMBL3828530C20H26N6O3398.4676 / 01.7Yes
58682D structureCHEMBL72287C22H16N2O324.3833 / 04.0Yes
59452D structureCHEMBL268964C13H12ClN5O2305.7224 / 22.2Yes
61012D structureCHEMBL2374412C19H24N6O4400.4399 / 51.6Yes
61062D structureCHEMBL604764C21H25N5O4411.4628 / 42.3Yes
4636132D structureCHEMBL2235589C21H25N5O4411.4628 / 42.3Yes
65392D structureCHEMBL1092868C16H13N7O2S367.3877 / 22.4Yes
65842D structureCHEMBL431370C11H12N4200.2452 / 22.0Yes
66442D structureCHEMBL27773C17H11BrN2O2355.1913 / 04.4Yes
67192D structureCHEMBL608327C18H18ClIN6O4544.7348 / 41.5No
67302D structureMRS 1754C26H26N6O4486.5326 / 24.9Yes
67552D structureCHEMBL603992C25H27N5O4S493.5829 / 44.4Yes
69592D structureCHEMBL387319C18H23N7O2369.4298 / 21.1Yes
69932D structure1,3-DibutylX-7-ribosideC18H35N5O4385.5098 / 4-0.3Yes
70772D structureCHEMBL286479C17H12BrN3O2370.2064 / 13.7Yes
72282D structureCHEMBL424433C15H20N4O4320.3495 / 00.9Yes
72932D structureCID 71508724C15H23N7O8429.3914 / 9-2.7No
74202D structureCHEMBL380914C19H19Cl2N7O5496.3058 / 51.3Yes
77012D structureCHEMBL56813C15H18N4OS2334.4564 / 13.4Yes
78042D structureCHEMBL2113585C28H33N7O4531.6178 / 42.5No
79112D structureCHEMBL27502C17H23N5O2329.4046 / 31.5Yes
79462D structureCHEMBL562427C25H27N5O6493.527 / 33.3Yes
80482D structureCHEMBL561364C27H29N5O6519.5587 / 23.3No
82232D structureCHEMBL337503C30H31N2O5S+531.6476 / 05.4No
84972D structureCHEMBL66811C24H19N7O2437.4637 / 13.6Yes
85142D structureCHEMBL206807C22H27N7O6485.5019 / 50.6Yes
85172D structureCHEMBL610394C22H27N7O6485.5019 / 50.6Yes
87622D structureCHEMBL22042C18H28N4O2332.4483 / 03.6Yes
88592D structureCHEMBL608748C20H29N5O5419.4827 / 51.0Yes
89452D structureCHEMBL2111718C23H25N5O2403.4866 / 24.7Yes
90342D structureCHEMBL184641C21H23F2N9O455.47411 / 22.8No
4639822D structureCHEMBL2235585C23H29N5O5455.5159 / 42.7Yes
90562D structureCHEMBL603927C23H29N5O5455.5159 / 42.7Yes
91282D structure172516-44-8C17H24O3S2340.4965 / 05.3No
92782D structureCHEMBL363647C19H18N6O2362.3936 / 22.0Yes
95012D structureCHEMBL408489C23H32N6O3S472.6086 / 24.3Yes
95032D structureCHEMBL54505C24H30N6O3450.5437 / 32.9Yes
97272D structureCHEMBL7897C15H15N5O4S361.3767 / 2N/AN/A
100152D structureCHEMBL223321C23H27ClF3N11O565.9913 / 22.9No
100382D structureCHEMBL2113603C29H31N7O4541.6128 / 42.7No
101522D structureCHEMBL2113426C19H23N5O3S401.4858 / 32.3Yes
4593082D structureCHEMBL2158244C15H10FNO2S287.3084 / 12.8Yes
102272D structureCHEMBL413046C26H31N7O6537.5779 / 52.0No
103092D structureCHEMBL177386C19H19Cl2N9O460.3239 / 22.9Yes
103392D structureCHEMBL609543C14H21N5O5339.3529 / 4-0.5Yes
104492D structureSB 204070 hydrochlorideC19H27ClN2O4382.8856 / 13.5Yes
106532D structureCHEMBL315562C16H11FN8O350.3178 / 12.3Yes
106672D structureCHEMBL444281C25H27N5O5477.5216 / 34.8Yes
109982D structureCHEMBL2113407C18H24N6O5404.4279 / 5-0.8Yes
110272D structure3-Isobutyl-1-methylxanthineC10H14N4O2222.2483 / 11.5Yes
110342D structureCHEMBL2113469C19H29N5O3S407.5338 / 33.0Yes
110382D structureCHEMBL303883C15H17N5267.3364 / 03.3Yes
111352D structureCHEMBL163813C26H34ClNO3S476.0725 / 08.2No
111722D structureCHEMBL612218C16H16ClN5O4377.7858 / 41.8Yes
112942D structure2-(furan-2-yl)-5-(methylthio)-[1,2,4]triazolo[1,5-a][1,3,5]triazin-7-amineC9H8N6OS248.2647 / 11.1Yes
113512D structureCHEMBL606228C19H28N4O4376.4577 / 42.8Yes
114402D structureCHEMBL2113704C16H15IN6418.2425 / 12.7Yes
115192D structureCHEMBL2113685C16H18IN5O2S471.3177 / 32.0Yes

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