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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

NameTrace amine-associated receptor 1
SpeciesHomo sapiens (Human)
GeneTAAR1
Synonymtrace amine receptor 1
TAR1
TaR-1
TA1 receptor
TRAR1
DiseaseN/A
Length339
Amino acid sequenceMMPFCHNIINISCVKNNWSNDVRASLYSLMVLIILTTLVGNLIVIVSISHFKQLHTPTNWLIHSMATVDFLLGCLVMPYSMVRSAEHCWYFGEVFCKIHTSTDIMLSSASIFHLSFISIDRYYAVCDPLRYKAKMNILVICVMIFISWSVPAVFAFGMIFLELNFKGAEEIYYKHVHCRGGCSVFFSKISGVLTFMTSFYIPGSIMLCVYYRIYLIAKEQARLISDANQKLQIGLEMKNGISQSKERKAVKTLGIVMGVFLICWCPFFICTVMDPFLHYIIPPTLNDVLIWFGYLNSTFNPMVYAFFYPWFRKALKMMLFGKIFQKDSSRCKLFLELSS
UniProtQ96RJ0
Protein Data BankN/A
GPCR-HGmod modelQ96RJ0
3D structure modelThis predicted structure model is from GPCR-EXP Q96RJ0.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL5857
IUPHAR364
DrugBankBE0001044

Known ligands

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Total entries: 728
Page:  / 8 

GLASS IDMoleculeFormulaMolecular weightH-bond acceptor / donorXlogPLipinski's druglikeness
6212D structureMLS003106542C11H14N2O2206.2453 / 11.5Yes
7692D structureSMR000164019C22H29NO3355.4784 / 04.2Yes
8132D structureMLS000553312C22H26Cl2N4O2449.3763 / 25.4No
8152D structureAC1MJLISC22H26Cl2N4O2449.3763 / 25.4No
13882D structureCHEMBL348369C17H17N3263.3442 / 13.2Yes
16112D structure2,6-DichlorophenethylamineC8H9Cl2N190.0671 / 12.5Yes
21142D structureMLS001236764C17H16FN3O3S2393.4516 / 22.9Yes
35902D structure(1S,2R)-2-phenylcyclopropanamineC9H11N133.1941 / 11.5Yes
35922D structuretranylcypromineC9H11N133.1941 / 11.5Yes
40582D structureMLS001171581C20H25NO5359.4226 / 31.3Yes
41272D structureMLS002182684C16H21FN2O3308.3534 / 10.6Yes
43632D structureMLS000586810C22H27NO3S385.5224 / 14.4Yes
5216042D structureSCHEMBL3621153C12H16N2O204.2732 / 11.9Yes
5216052D structureSCHEMBL3620932C12H16N2O204.2732 / 11.9Yes
53012D structureMLS003151666C16H18N4266.3484 / 12.4Yes
5216192D structureSCHEMBL1833658C11H14N2O2206.2453 / 11.3Yes
62852D structureAC1LCNHIC14H12ClFN4290.7266 / 3N/AN/A
5216382D structureF2101-0207C14H19N3229.3272 / 12.1Yes
67722D structureSMR000135892C18H20N2O4328.3685 / 40.1Yes
77462D structureSMR000115245C14H18ClFN2268.762 / 2N/AN/A
86752D structureMLS000122379C18H19N3O2309.3693 / 32.1Yes
86842D structureCHEMBL2206369C13H16ClN3249.7422 / 13.1Yes
93332D structureMLS003777896C28H34ClN3O3496.0483 / 25.3No
102492D structureCHEMBL2206375C13H16ClN3249.7422 / 13.1Yes
4593172D structuretryptamineC10H12N2160.221 / 21.6Yes
116102D structureMLS003123738C11H14N4OS250.326 / 21.7Yes
120322D structureMLS000705798C20H19NO4S369.4356 / 3N/AN/A
124232D structureSMR000204166C14H21N3S263.4032 / 13.0Yes
125802D structureMLS003777895C26H26ClN3O3S496.0224 / 24.9Yes
126962D structureCHEMBL2206389C11H14ClN5251.7184 / 12.1Yes
133462D structureCHEMBL154103C12H12ClNO3253.6823 / 21.9Yes
135372D structureMLS000696725C26H27N3O3429.523 / 03.3Yes
136952D structureMLS003510317C22H26N2O2350.4623 / 04.7Yes
145202D structure3-FluorophenethylamineC8H10FN139.1732 / 11.7Yes
145922D structureMethyl-(2-phenyl-propyl)-amineC10H15N149.2371 / 12.1Yes
151122D structureCHEMBL2206401C10H11N3173.2192 / 21.6Yes
162872D structure1477-68-5C9H14ClNO2203.6663 / 3N/AN/A
164312D structureMLS003510317C24H27F3N2O4464.4858 / 1N/AN/A
169182D structure17596-79-1C9H13N135.211 / 12.2Yes
169192D structure28163-64-6C9H13N135.211 / 12.2Yes
5533322D structure2-PhenylpropylamineC9H13N135.211 / 12.2Yes
174922D structureMLS000391823C18H18ClN5O2371.8253 / 32.9Yes
5220262D structureSCHEMBL3617893C11H13ClN2O224.6882 / 12.2Yes
5578512D structureAC1NYINJC16H19N5O2313.3617 / 22.3Yes
213902D structureMLS003777871C25H34ClN3O3460.0153 / 24.4Yes
215682D structureCHEMBL2206408C13H15N3213.2842 / 12.1Yes
217322D structureMLS000777768C17H19NO2269.3443 / 12.9Yes
225762D structureMLS000103636C20H17FN4OS380.4416 / 14.0Yes
228992D structureMLS001000987C17H21NO3287.3593 / 22.7Yes
237512D structurePhenethylamineC8H11N121.1831 / 11.4Yes
238212D structureMLS000913198C22H23NO4S397.4894 / 14.1Yes
244442D structureMLS000589773C20H23N3O2S369.4834 / 13.9Yes
248072D structurelysergolC16H18N2O254.3332 / 22.2Yes
252972D structure2-chloro-1-[2,5-dimethyl-1-(2-phenylethyl)-1H-pyrrol-3-yl]ethanoneC16H18ClNO275.7761 / 03.7Yes
253252D structureAC1LCW9IC13H17ClN2236.7432 / 2N/AN/A
255162D structureMLS000705195C17H25NO3291.3913 / 22.8Yes
257122D structureCHEMBL2206387C12H16N4216.2883 / 11.8Yes
260182D structureCHEMBL131145C10H14ClN183.6791 / 03.2Yes
269172D structureMLS000700078C20H16N2O6380.3566 / 13.2Yes
269202D structureMLS001360438C13H16N4228.2994 / 12.9Yes
288992D structure3-chloro-5-(phenethylamino)-4-isothiazolecarbonitrileC12H10ClN3S263.7434 / 14.5Yes
299232D structureMLS001177999C15H23N217.3561 / 14.1Yes
299502D structure52516-30-0C9H10F3N189.1814 / 12.1Yes
304192D structureSMR000040109C22H26ClNO3387.9044 / 1N/AN/A
307812D structureMLS001106103C23H28FN3O2397.4944 / 23.0Yes
5582302D structureAC1NZFJCC15H14N4O5330.37 / 61.2No
315572D structureMLS003551996C31H46N2O5526.7185 / 16.0No
315772D structureMLS003123728C18H20N4O2S356.4447 / 22.7Yes
321512D structureMLS003777904C29H30ClN3O3504.0273 / 25.2No
331662D structureMLS000622033C23H22FN5387.4625 / 04.3Yes
5583022D structure4-chloro-2-{[(2-phenylethyl)imino]methyl}phenolC15H14ClNO259.7332 / 13.7Yes
343162D structureMLS002245100C19H21ClN4O3388.8523 / 31.9Yes
343572D structureMLS002182285C22H25F3N2O5S2518.56610 / 13.5No
343682D structureMLS003777870C28H27Cl3N4O3573.8994 / 25.4No
5225802D structureCHEMBL3781461C10H12N2O176.2192 / 11.3Yes
358392D structureTetryzolineC13H16N2200.2851 / 11.8Yes
378812D structure3-(3-phenylpyrrolidin-1-yl)-1-(3,4,5-trimethoxyphenyl)propan-1-oneC22H27NO4369.4615 / 03.4Yes
380742D structureMLS000675224C20H26BrN3O5S3564.5288 / 33.2No
385212D structureMLS001180715C12H14ClNO223.72 / 2N/AN/A
396622D structureMLS001181838C15H15N3O2269.3042 / 32.2Yes
399042D structureAC1MBTHFC8H10Cl2N2S237.1422 / 2N/AN/A
399312D structureMolPort-000-735-185C21H24ClNO3373.8774 / 1N/AN/A
401422D structureN,N-Dimethyl-2-bromophenylethylamineC10H14BrN228.1331 / 02.9Yes
410162D structureCHEMBL447626C23H26INO3491.3694 / 16.1No
414102D structure2C-CC10H14ClNO2215.6773 / 12.1Yes
421032D structureSMR000011654C17H20ClNOS321.8633 / 1N/AN/A
424352D structureMLS000521189C21H20FNO4S401.4525 / 13.4Yes
434632D structure2-(4-BROMOPHENYL)-N-METHYLETHANAMINEC9H12BrN214.1061 / 12.4Yes
441552D structure4-FluorophenethylamineC8H10FN139.1732 / 11.3Yes
444252D structureMLS003777924C25H28Cl3N3O3524.8673 / 25.8No
5228232D structureSCHEMBL3610211C10H11ClN2O2226.663 / 11.6Yes
454262D structureMLS000334339C21H23Cl2NO6456.3167 / 4N/AN/A
460582D structurenaphazolineC14H14N2210.281 / 12.1Yes
464022D structureMLS003551927C30H34N2O7534.6097 / 13.1No
468142D structure124534-88-9C11H13ClN2S240.7493 / 2N/AN/A
473632D structureMLS002206728C17H15N5O2S353.45 / 21.9Yes
482212D structureMLS003509126C22H25FN2O352.4533 / 05.4No
492382D structureMLS001140057C21H21NO6383.46 / 13.7Yes
509692D structureMLS000124020C16H17ClN4O2332.7886 / 5N/AN/A
515572D structureFENOLDOPAM MESYLATEC17H20ClNO6S401.8587 / 5N/AN/A

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