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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

Name5-hydroxytryptamine receptor 1A
SpeciesHomo sapiens (Human)
GeneHTR1A
Synonym5-HT1A receptor
ADRB2RL1
ADRBRL1
serotonin receptor 1A
5-HT1A
[ Show all ]
DiseaseMajor depressive disorder; Episode; Anxiety
Migraine
Mood disorder
Pain
Parkinson's disease
[ Show all ]
Length422
Amino acid sequenceMDVLSPGQGNNTTSPPAPFETGGNTTGISDVTVSYQVITSLLLGTLIFCAVLGNACVVAAIALERSLQNVANYLIGSLAVTDLMVSVLVLPMAALYQVLNKWTLGQVTCDLFIALDVLCCTSSILHLCAIALDRYWAITDPIDYVNKRTPRRAAALISLTWLIGFLISIPPMLGWRTPEDRSDPDACTISKDHGYTIYSTFGAFYIPLLLMLVLYGRIFRAARFRIRKTVKKVEKTGADTRHGASPAPQPKKSVNGESGSRNWRLGVESKAGGALCANGAVRQGDDGAALEVIEVHRVGNSKEHLPLPSEAGPTPCAPASFERKNERNAEAKRKMALARERKTVKTLGIIMGTFILCWLPFFIVALVLPFCESSCHMPTLLGAIINWLGYSNSLLNPVIYAYFNKDFQNAFKKIIKCKFCRQ
UniProtP08908
Protein Data BankN/A
GPCR-HGmod modelP08908
3D structure modelThis predicted structure model is from GPCR-EXP P08908.
BioLiPN/A
Therapeutic Target DatabaseT78709
ChEMBLCHEMBL214
IUPHAR1
DrugBankBE0000291

Known ligands

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Total entries: 5551
Page:  / 56 

GLASS IDMoleculeFormulaMolecular weightH-bond acceptor / donorXlogPLipinski's druglikeness
372D structureMLS000077136C12H11N3O6293.2358 / 1-0.1Yes
5573092D structure3-(5-(4-(4-(3,5-difluoro-2-oxopyridin-1(2H)-yl)phenyl)piperazin-1-yl)pentyl)-1H-indole-5-carbonitrileC29H29F2N5O501.5826 / 15.1No
912D structureEticloprideC17H25ClN2O3340.8484 / 23.1Yes
982D structureAC1O8PYYC17H25ClN2O3340.8484 / 23.1Yes
1722D structureCHEMBL2111779C24H25N3O2387.4834 / 13.8Yes
1752D structureCHEMBL119800C24H25N3O2387.4834 / 13.8Yes
3762D structureMLS000080863C14H20N2O3S296.3854 / 32.3Yes
4112D structureCHEMBL2205042C17H21ClN2OS336.8784 / 2N/AN/A
4862D structureCHEMBL54125C22H21FN4360.4364 / 04.7Yes
7342D structureCHEMBL49950C22H33N5O3415.5387 / 11.8Yes
5214592D structureCHEMBL3818128C19H23ClFN319.8482 / 1N/AN/A
8772D structureCHEMBL598037C20H21NO2307.3933 / 13.6Yes
8792D structureMLS000068755C22H18ClN5O403.874 / 14.7Yes
11212D structureCHEMBL2205048C17H20N2OS300.424 / 13.4Yes
11952D structureSMR000092791C21H16BrN3O3438.2815 / 14.6Yes
5532532D structure7-Hydroxy RisperidoneC23H27FN4O3426.4927 / 11.7Yes
13072D structureCHEMBL135890C21H24N2O2S368.4955 / 23.7Yes
13272D structureCHEMBL109839C21H34N2O330.5162 / 25.6No
14762D structure4365 CTC14H20N2O232.3272 / 12.7Yes
14912D structureCHEMBL413777C23H31NO2353.5063 / 15.7No
16332D structureSCHEMBL6114888C25H30BrNO5504.4216 / 23.8No
16582D structureCHEMBL210461C31H35Cl2N3O536.5413 / 17.3No
16972D structureCHEMBL470849C25H28N4O2416.5255 / 13.8Yes
17402D structureCHEMBL3264371C21H21F2N5O397.437 / 12.6Yes
17522D structureCHEMBL89448C16H24N4O2304.3944 / 31.4Yes
18672D structureCHEMBL53662C23H23FN4O390.4625 / 04.7Yes
19692D structureRutaecarpineC18H13N3O287.3222 / 13.0Yes
19822D structureMLS000086795C24H28ClN5O4485.9696 / 22.0Yes
19992D structureCHEMBL574700C36H46N6O3610.8038 / 25.4No
20462D structureCHEMBL252818C24H28N4OS420.5755 / 14.1Yes
22492D structureCHEMBL288244C23H22Cl2FN3OS478.4075 / 14.8Yes
22682D structure1-(cyclohexylmethyl)pyrrolidineC11H21N167.2961 / 03.1Yes
29152D structureCHEMBL446459C14H19F2N3O283.3234 / 22.6Yes
29792D structureCHEMBL317532C26H28FNO4437.5116 / 14.9Yes
30422D structureCHEMBL1255085C23H25NO5395.4556 / 33.9Yes
31102D structureCHEMBL1794795C21H28N2O6404.4637 / 2N/AN/A
5215322D structureCHEMBL3818805C24H27ClN4O422.9572 / 24.8Yes
31362D structureAC1N0YGAC3H7NO4S153.1525 / 2-4.7Yes
5479302D structureCHEMBL3941102C28H31F3N4O2512.5778 / 13.9No
32452D structureCHEMBL2442997C28H34N4O3474.6056 / 13.0Yes
33302D structureCHEMBL196961C29H33N5O2S515.6767 / 04.0No
33812D structureCHEMBL135295C21H22N2OS350.484 / 04.1Yes
34072D structureCHEMBL1642882C18H19ClN4O2S390.8865 / 33.4Yes
36002D structure2-PhenylcyclopropanamineC9H11N133.1941 / 11.5Yes
36442D structureCHEMBL3235731C22H34N4O3402.5395 / 11.8Yes
4633312D structureCHEMBL3597637C25H29ClN4O2452.9835 / 14.4Yes
36892D structureCHEMBL137185C21H21ClN2OS384.9224 / 05.0Yes
4418502D structureCHEMBL3342860C27H32F3N3O4519.5659 / 03.9No
37432D structuretetrahydropalmatineC21H25NO4355.4345 / 03.2Yes
37452D structureD-TetrahydropalmatineC21H25NO4355.4345 / 03.2Yes
5532602D structureZalospironeC24H29N5O2419.5296 / 01.4Yes
38622D structureCHEMBL180119C24H31NO349.5182 / 05.5No
38882D structureMLS000078794C11H13N5O231.2595 / 00.6Yes
40992D structureCHEMBL1173578C21H16ClN5O2S2469.9627 / 04.6Yes
42892D structureCHEMBL1784932C40H56N6O5S732.9859 / 16.5No
43062D structureButanedioic acid, compd. with 5-methoxy-3-(1,2,3,6-tetrahydro-4-pyridinyl)-1H-indole (1:1)C18H22N2O5346.3836 / 4N/AN/A
45622D structureCHEMBL495161C25H30N4O2418.5415 / 13.1Yes
46102D structureCHEMBL2159474C16H17Cl3N2O3S2455.7936 / 15.0Yes
47722D structureCHEMBL599691C24H23FN2O2390.4584 / 14.7Yes
47842D structureCHEMBL268274C17H25N3O287.4073 / 13.0Yes
48292D structureCHEMBL232206C29H26F3N5S533.6179 / 06.2No
49642D structureCHEMBL1096802C29H33N5O467.6176 / 05.1No
50322D structureCHEMBL211135C17H17Cl2N5362.2584 / 03.4Yes
50582D structureBDBM50068818C32H39N5O6589.6938 / 22.9No
52302D structureSMR000016478C22H30N6O4442.526 / 01.4Yes
52342D structureCHEMBL196744C21H24Cl2FN3O424.3414 / 14.9Yes
52492D structureSB-258719C18H30N2O2S338.514 / 03.5Yes
54392D structureLesopitronC15H21ClN6320.8255 / 01.8Yes
55792D structureCHEMBL3144354C28H29N3O4S503.6176 / 14.0No
55982D structureCHEMBL158749C17H23NO257.3772 / 13.7Yes
55992D structureCHEMBL158623C17H23NO257.3772 / 13.7Yes
56892D structureAC1L1HUKC29H28ClN3O4518.014 / 25.2No
5216272D structureCHEMBL3770072C28H32N2O412.5773 / 05.0Yes
57462D structureAHOUBRCZNHFOSL-UHFFFAOYSA-NC19H20FNO3329.3715 / 13.5Yes
57652D structureparoxetineC19H20FNO3329.3715 / 13.5Yes
58812D structureCHEMBL209176C21H29N3O2S387.5425 / 13.6Yes
60842D structureCHEMBL551964C27H25N5O2451.537 / 04.3Yes
60892D structureCID 10072510C27H25N5O2451.537 / 04.3Yes
61432D structureCHEMBL144128C28H38N6O2490.6526 / 42.3Yes
62332D structureCHEMBL604115C23H21ClN2O376.8842 / 15.2No
5216362D structureCHEMBL3758684C23H30ClN3O2415.9623 / 24.9Yes
62762D structureCHEMBL76237C19H22N2O3S358.4564 / 03.5Yes
64362D structureCHEMBL80230C24H23N3O3401.4665 / 23.8Yes
65322D structure10-GingerolC21H34O4350.4994 / 25.3No
66482D structureCHEMBL1784934C40H57N7O5S748.010 / 25.0No
4419512D structureCHEMBL3409037C30H48N4O2496.744 / 04.9Yes
68052D structureCHEMBL158210C16H21NO243.352 / 23.4Yes
4419732D structureCHEMBL3358498C24H27FN4O406.5055 / 14.2Yes
4637062D structureCHEMBL3633757C26H24BrNO4494.3855 / 05.4No
5361232D structureCHEMBL3899832C22H19N5O4417.4258 / 23.6Yes
70512D structureCHEMBL1788190C19H27N3O313.4452 / 23.8Yes
70522D structureCHEMBL1744036C19H27N3O313.4452 / 23.8Yes
70872D structureCHEMBL606384C25H26N2O2386.4953 / 14.9Yes
71752D structureCHEMBL2159481C24H24F2N2O3S458.5247 / 14.6Yes
72602D structureCHEMBL54914C15H17N5267.3364 / 02.4Yes
73452D structureCHEMBL179648C21H26N2O322.4523 / 03.7Yes
74502D structureCHEMBL377697C25H40N4O3S476.686 / 23.7Yes
4420202D structureCHEMBL3342852C19H28N2O3S364.5046 / 02.5Yes
5479802D structureCHEMBL3983496C32H41N3O4531.6976 / 15.2No
78562D structureCHEMBL63114C14H15N3S257.3553 / 04.2Yes

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