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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
SpeciesCavia porcellus (Guinea pig)
GeneADORA1
SynonymN/A
DiseaseN/A for non-human GPCRs
Length326
Amino acid sequenceMPHSVSAFQAAYIGIEVLIALVSVPGNVLVIWAVKVNQALRDATFCFIASLAVADVAVGALVIPLAILINIGPQTYFHTCLMVACPVLILTQSSILALLAIAVDRYLRVKIPLRYKTVVTPRRAAVAIAGCWILSLVVGLTPMFGWNNLSKIEMAWAANGSVGEPVIKCEFEKVISMEYMVYFNFFVWVLPPLLLMVLIYLEVFYLIRKQLSKKVSASSGDPQKYYGKELKIAKSLALILFLFALSWLPLHILNCITLFCPTCHKPTILTYIAIFLTHGNSAMNPIVYAFRIQKFRVTFLKIWNDHFRCQPEPPIDEDLPEEKVDD
UniProtP47745
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL2304404
IUPHARN/A
DrugBankN/A

Known ligands

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Total entries: 454
Page:  / 5 

GLASS IDMoleculeFormulaMolecular weightH-bond acceptor / donorXlogPLipinski's druglikeness
30972D structureCHEMBL131242C33H42N8O4614.75110 / 53.7No
39272D structureCHEMBL443274C15H20N4O2288.3513 / 22.6Yes
42042D structureCHEMBL75597C21H26N4O2366.4653 / 04.0Yes
50112D structureCHEMBL608020C18H22N6O3S2434.53310 / 32.6Yes
50922D structureCHEMBL104491C18H24N4O2328.4163 / 13.8Yes
59092D structureCID 46876614C12H17N7O4323.31310 / 5-0.8Yes
66922D structureCHEMBL2311198C11H15N5O5297.2719 / 4-0.7Yes
80832D structureCHEMBL102859C14H20N4O2276.343 / 12.9Yes
81052D structureCHEMBL76482C19H22N4O5386.4086 / 22.5Yes
82562D structureCHEMBL122703C15H17N3O2271.325 / 02.5Yes
94832D structureCID 46876652C16H18N8O4386.37211 / 5-0.2No
118312D structureCID 53656690C19H22N4O2338.4113 / 14.6Yes
118322D structureCHEMBL283908C19H22N4O2338.4113 / 14.6Yes
5576382D structureBDBM50368466C17H18FN7O4403.37411 / 41.1No
5576442D structureBDBM50368483C17H18ClN7O4419.82610 / 41.6Yes
157012D structureCID 46876622C18H21N7O4399.41110 / 50.8Yes
166062D structureCHEMBL446679C12H18N4O2250.3023 / 12.2Yes
169712D structureCHEMBL2112181C18H23N5O5389.4128 / 40.3Yes
169812D structureCHEMBL605254C19H29N5O5407.4719 / 42.7Yes
193012D structureCHEMBL610444C10H15N7O4297.27510 / 6-1.5No
194392D structureCHEMBL77323C20H24N4O3368.4374 / 14.9Yes
219892D structureCHEMBL131175C29H34N6O4530.6299 / 54.6No
248532D structure2-ChloroadenosineC10H12ClN5O4301.6878 / 4-0.1Yes
274652D structureCHEMBL143565C21H26N4O2366.4653 / 15.2No
5581022D structureCHEMBL400330C24H29ClN6O5516.9839 / 42.5No
280182D structureCHEMBL345983C13H21N5O2279.3444 / 21.6Yes
288202D structureCHEMBL606510C13H19N5O5325.3259 / 40.1Yes
5581592D structure2'-Me-tecadenosonC15H21N5O5351.3639 / 4-1.0Yes
296152D structureCID 632916C18H20N4O5372.3816 / 11.8Yes
296172D structureCHEMBL26979C18H20N4O5372.3816 / 11.8Yes
308622D structureCHEMBL356458C18H30N4O2334.4643 / 15.3No
321792D structureCHEMBL142576C24H38N4O2414.5943 / 17.9No
323382D structureCID 46876729C17H18ClN7O4419.82610 / 51.5Yes
327662D structureCHEMBL423016C24H26N4O2402.4983 / 15.7No
330902D structureDPMAC27H31N5O6521.57410 / 43.3No
330932D structureCHEMBL1950555C27H31N5O6521.57410 / 43.3No
334462D structureCID 46876685C21H21N7O4435.44410 / 52.1Yes
339132D structureCHEMBL605667C16H19N5O5S393.41810 / 40.9Yes
5583172D structure205171-06-8C16H23N5O4349.3918 / 40.3Yes
343942D structureCHEMBL29209C11H14N4O4266.2575 / 10.1Yes
359412D structureCHEMBL337001C10H14N4O2222.2483 / 10.4Yes
359632D structurepentoxifyllineC13H18N4O3278.3124 / 00.3Yes
367882D structureCHEMBL72669C15H13ClF3N5355.7497 / 14.7Yes
5584532D structureBDBM50368468C18H21N7O4399.41110 / 41.4Yes
395012D structureCHEMBL28980C13H18N4O2262.3133 / 01.5Yes
397552D structureCID 46876686C15H17N7O4S391.40611 / 50.9No
398162D structureCID 3072468C24H32N4O5456.5436 / 15.3No
398172D structure(E)-1,3-Dibutyl-8-(3,4,5-trimethoxystyryl)xanthineC24H32N4O5456.5436 / 15.3No
402652D structureCID 46876681C19H23N7O4413.43810 / 51.1Yes
4679322D structureSCHEMBL939637C17H18ClN7O4419.82610 / 51.5Yes
425652D structureCHEMBL33115C19H24N4O2340.4273 / 14.6Yes
5585922D structureBDBM50368476C17H18FN7O4403.37411 / 41.1No
469642D structureCHEMBL76585C21H26N4O2366.4653 / 04.3Yes
476102D structureCHEMBL28295C14H23N5O2293.3714 / 00.8Yes
494472D structureCHEMBL609233C19H25N7O3S431.5159 / 31.6Yes
495192D structureCHEMBL105100C13H18N4O2262.3133 / 22.0Yes
511822D structureCHEMBL368276C24H24N4O2400.4823 / 15.4No
512502D structureCHEMBL264033C18H28N4O2332.4483 / 15.1No
521602D structureBDBM50421976C17H23N7O4389.41610 / 41.1Yes
541392D structureCHEMBL28298C12H18N4O3266.3014 / 00.2Yes
547142D structureCHEMBL27969C12H16N4O3264.2854 / 00.3Yes
564392D structureBDBM50421981C13H19N7O4337.3410 / 40.1Yes
600212D structureCHEMBL28683C12H15N5O2261.2854 / 00.1Yes
604782D structureCHEMBL417654C10H14N4O2222.2483 / 00.8Yes
641042D structureCHEMBL608611C20H22FN5O5431.42410 / 31.6Yes
652482D structureCID 46876684C18H20FN7O4417.40111 / 51.2No
5593492D structureCHEMBL254065C20H29ClN6O5468.9399 / 41.9Yes
695142D structureCID 46876053C18H21N7O4399.41110 / 51.3Yes
705062D structureCHEMBL603589C17H25N5O5379.4179 / 41.8Yes
741992D structureCHEMBL29272C11H16N4O3252.2744 / 10.9Yes
5596382D structureCHEMBL173327C13H16N6O2S320.3716 / 12.5Yes
756552D structureCHEMBL176320C15H22N4O2290.3673 / 13.7Yes
758662D structureCID 46876669C18H21N7O5415.4111 / 50.9No
768262D structure8-Cyclopentyl-1,3-dipropylxanthineC16H24N4O2304.3943 / 14.0Yes
774432D structureCHEMBL604223C16H25N5O5367.4069 / 41.3Yes
5597032D structureCHEMBL254271C24H29ClN6O4S533.0449 / 43.1No
792952D structureXanthine amine congenerC21H28N6O4428.4936 / 32.7Yes
797742D structureCHEMBL605273C15H23N5O4337.388 / 41.3Yes
5379692D structureFK-838C21H18N4O3374.45 / 12.1Yes
805832D structureBDBM50421982C18H27N7O4405.45910 / 42.4Yes
813082D structureBDBM50119134C17H25N7O4391.43210 / 41.7Yes
819942D structureCHEMBL610953C20H22FN5O5431.42410 / 31.6Yes
834922D structureCHEMBL605469C19H23N5O4385.4248 / 32.1Yes
843842D structureCID 46876610C16H18N8O4386.37211 / 5-0.2No
850352D structureCHEMBL106937C14H18N4O2274.3243 / 12.3Yes
852122D structureCID 46876653C17H18FN7O4403.37411 / 51.0No
866472D structureCHEMBL603373C22H31N5O6461.51910 / 41.6Yes
876092D structureCHEMBL606082C17H19N5O5373.3699 / 40.7Yes
881262D structureCHEMBL321507C19H26N4O2342.4433 / 13.5Yes
929452D structureCHEMBL605672C16H17N5O5359.3429 / 40.8Yes
933082D structureCHEMBL28684C12H17N5O3279.34 / 1-0.8Yes
936112D structureCHEMBL344992C21H25FN4O2384.4554 / 15.6No
939172D structureCHEMBL130503C10H14N4O2222.2483 / 11.3Yes
939402D structureCHEMBL286741C13H21N5O2279.3444 / 00.4Yes
5602772D structureCHEMBL399306C24H30N6O4S498.6029 / 42.2Yes
971962D structureCID 46876088C13H19N7O4337.3410 / 5-0.3Yes
980462D structureCHEMBL2092779C20H21F2N5O4S465.47611 / 32.2No
987812D structureCHEMBL313780C17H24N4O2316.4053 / 14.2Yes
1001542D structureCHEMBL318537C20H30N4O2358.4863 / 15.4No
1001742D structure3-MethylxanthineC6H6N4O2166.143 / 2-0.7Yes

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