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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 2A
SpeciesHomo sapiens (Human)
GeneHTR2A
Synonym5-HT-2
serotonin receptor 2A
serotonin 5HT-2 receptor
5-HT-2A
5-HT2A receptor
[ Show all ]
DiseaseDepression
Unspecified
Diabetes
Erythropoietic porphyria
Fibromyalgia
[ Show all ]
Length471
Amino acid sequenceMDILCEENTSLSSTTNSLMQLNDDTRLYSNDFNSGEANTSDAFNWTVDSENRTNLSCEGCLSPSCLSLLHLQEKNWSALLTAVVIILTIAGNILVIMAVSLEKKLQNATNYFLMSLAIADMLLGFLVMPVSMLTILYGYRWPLPSKLCAVWIYLDVLFSTASIMHLCAISLDRYVAIQNPIHHSRFNSRTKAFLKIIAVWTISVGISMPIPVFGLQDDSKVFKEGSCLLADDNFVLIGSFVSFFIPLTIMVITYFLTIKSLQKEATLCVSDLGTRAKLASFSFLPQSSLSSEKLFQRSIHREPGSYTGRRTMQSISNEQKACKVLGIVFFLFVVMWCPFFITNIMAVICKESCNEDVIGALLNVFVWIGYLSSAVNPLVYTLFNKTYRSAFSRYIQCQYKENKKPLQLILVNTIPALAYKSSQLQMGQKKNSKQDAKTTDNDCSMVALGKQHSEEASKDNSDGVNEKVSCV
UniProtP28223
Protein Data Bank6a93, 6a94
GPCR-HGmod modelP28223
3D structure modelThis structure is from PDB ID 6a93.
BioLiPBL0441025,BL0441028, BL0441031, BL0441030,BL0441033, BL0441029,BL0441032, BL0441026, BL0441024,BL0441027
Therapeutic Target DatabaseT32060
ChEMBLCHEMBL224
IUPHAR6
DrugBankBE0000451

Known ligands

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Total entries: 4786
Page:  / 48 

GLASS IDMoleculeFormulaMolecular weightH-bond acceptor / donorXlogPLipinski's druglikeness
1422D structureCHEMBL187888C13H15N3213.2843 / 11.6Yes
3412D structureCHEMBL475382C17H19ClN2O302.8022 / 3N/AN/A
4532D structureCHEMBL488069C16H14Cl2F3NO364.1895 / 05.4No
4630122D structureCHEMBL373873C25H30Cl2N6O501.4565 / 14.9No
5312D structureAF-353C14H17IN4O2400.226 / 22.8Yes
5214622D structureCHEMBL3818128C19H23ClFN319.8482 / 1N/AN/A
8652D structureCHEMBL75065C20H23FINO439.3133 / 14.6Yes
8872D structureCHEMBL1933396C13H19FN2O2S286.3655 / 01.8Yes
9202D structureCHEMBL1086755C27H32Cl2N4O499.483 / 15.5No
10152D structureCHEMBL2205816C18H20N2O280.3713 / 11.8Yes
5532542D structure7-Hydroxy RisperidoneC23H27FN4O3426.4927 / 11.7Yes
12652D structureCHEMBL493129C11H16ClNO213.7052 / 2N/AN/A
13612D structureCHEMBL2337104C15H19ClN2O278.782 / 3N/AN/A
14182D structureCHEMBL119145C22H24N4O2376.463 / 32.4Yes
16892D structureCHEMBL1271756C22H30Cl3N5O486.8665 / 2N/AN/A
19052D structureCHEMBL96732C20H23NO293.412 / 03.6Yes
19092D structureCHEMBL329566C20H23NO293.412 / 03.6Yes
19102D structureCHEMBL92667C20H23NO293.412 / 03.6Yes
19132D structureCHEMBL329268C20H23NO293.412 / 03.6Yes
19162D structureCHEMBL327651C20H23NO293.412 / 03.6Yes
19242D structureCHEMBL371352C20H23NO293.412 / 03.6Yes
19642D structureCHEMBL484356C23H24BrNO2426.3543 / 4N/AN/A
19762D structureCHEMBL3652596C18H16BrClN4O3S483.7656 / 23.0Yes
20442D structureCHEMBL252818C24H28N4OS420.5755 / 14.1Yes
21622D structuredonepezilC24H29NO3379.54 / 04.3Yes
21902D structureCHEMBL458002C29H28ClN5O2514.0265 / 24.3No
22192D structureCHEMBL501896C17H17ClF3N327.7754 / 2N/AN/A
22662D structure1-(cyclohexylmethyl)pyrrolidineC11H21N167.2961 / 03.1Yes
23002D structureCHEMBL1271815C24H35N5O409.5785 / 14.1Yes
23352D structureCHEMBL249797C24H28N4O2S436.5746 / 23.9Yes
23602D structureCHEMBL488241C16H19NO241.3342 / 13.5Yes
24072D structureCHEMBL425069C27H28ClN5O3506.0036 / 14.3No
29512D structureCHEMBL2337496C12H13ClN2O236.6992 / 21.4Yes
5215292D structureCHEMBL3818805C24H27ClN4O422.9572 / 24.8Yes
31652D structureCHEMBL175586C19H20F3NO2S383.4296 / 04.2Yes
32622D structureCHEMBL1084895C24H25F3N4O2458.4857 / 14.1Yes
34852D structure1,2,3,4-tetrahydropyrazino[1,2-a]indoleC11H12N2172.2311 / 11.1Yes
35962D structure2-PhenylcyclopropanamineC9H11N133.1941 / 11.5Yes
36062D structureSCHEMBL3561492C13H16N2O216.2842 / 11.3Yes
36092D structureSCHEMBL3555280C13H16N2O216.2842 / 11.3Yes
36172D structureCHEMBL360492C11H13ClFN213.682 / 12.8Yes
4633322D structureCHEMBL3597637C25H29ClN4O2452.9835 / 14.4Yes
37402D structuretetrahydropalmatineC21H25NO4355.4345 / 03.2Yes
37442D structureD-TetrahydropalmatineC21H25NO4355.4345 / 03.2Yes
39062D structureCHEMBL3218981C18H28N2O288.4352 / 13.0Yes
39802D structureCHEMBL2179699C25H38N4O410.6063 / 15.8No
40962D structureCHEMBL1173578C21H16ClN5O2S2469.9627 / 04.6Yes
43052D structureButanedioic acid, compd. with 5-methoxy-3-(1,2,3,6-tetrahydro-4-pyridinyl)-1H-indole (1:1)C18H22N2O5346.3836 / 4N/AN/A
43282D structuresulconazoleC18H15Cl3N2S397.7422 / 06.1No
5215742D structureCHEMBL3735911C29H35NO5477.6016 / 06.2No
47912D structureCHEMBL601885C30H40N4O3S536.7357 / 05.7No
48102D structureCHEMBL376456C12H14N2O2218.2563 / 10.3Yes
48302D structureCHEMBL232206C29H26F3N5S533.6179 / 06.2No
49552D structure5HT6-ligand-1C20H22BrN3O2S448.3794 / 03.6Yes
50472D structureCHEMBL397112C19H12ClF2NO2S391.8175 / 04.8Yes
50652D structureBDBM50068818C32H39N5O6589.6938 / 22.9No
51062D structureCHEMBL55207C20H16Cl2N4O2415.2744 / 14.0Yes
51642D structureCHEMBL220521C12H13ClN2O2252.6983 / 10.9Yes
52402D structureCHEMBL420867C22H26N4O362.4772 / 22.5Yes
52462D structureSB-258719C18H30N2O2S338.514 / 03.5Yes
52602D structureCHEMBL299726C20H17ClN4O2380.8324 / 13.5Yes
54212D structureCHEMBL596148C18H20N2O2S328.433 / 13.1Yes
5532682D structureUNII-H0EVX3PS4BC23H30N2O2366.5053 / 03.7Yes
55312D structureRac-3,8,11-TribromonantenineC20H18Br3NO4576.0795 / 05.3No
56062D structureRac-3-BromonantenineC20H20BrNO4418.2875 / 03.9Yes
56772D structureAC1L1HUKC29H28ClN3O4518.014 / 25.2No
57442D structureAHOUBRCZNHFOSL-UHFFFAOYSA-NC19H20FNO3329.3715 / 13.5Yes
57752D structureparoxetineC19H20FNO3329.3715 / 13.5Yes
59862D structureCHEMBL601457C27H33N3O2S463.645 / 05.1No
5360932D structureCHEMBL3974905C11H13N159.2321 / 12.1Yes
5360942D structureCHEMBL3912463C11H13N159.2321 / 12.1Yes
5360952D structure5-phenylpent-4-yn-2-amineC11H13N159.2321 / 12.1Yes
62462D structureCHEMBL1214659C17H19BrF2N4O413.2675 / 02.7Yes
66182D structurecarbacholC6H15ClN2O2182.6483 / 1N/AN/A
4419532D structureCHEMBL3409037C30H48N4O2496.744 / 04.9Yes
4419672D structureCID 118733773C15H19ClF3NO3353.7667 / 2N/AN/A
67632D structureCHEMBL404581C21H20FN3333.414 / 13.7Yes
68012D structureCHEMBL577831C17H21ClN4O332.8324 / 11.7Yes
4419762D structureCHEMBL3358498C24H27FN4O406.5055 / 14.2Yes
4637092D structureCHEMBL3633757C26H24BrNO4494.3855 / 05.4No
69862D structureCHEMBL493129C11H15NO177.2472 / 11.4Yes
5361392D structureCHEMBL3899832C22H19N5O4417.4258 / 23.6Yes
71452D structureCHEMBL234532C23H26Cl2N2O3449.3724 / 05.0Yes
71552D structureSCHEMBL2683101C28H39Cl2N5O532.5544 / 3N/ANo
74682D structureN-Methyl-3,3-diphenylpropylamineC16H19N225.3351 / 13.6Yes
75972D structureCHEMBL233440C26H31N3O4449.5515 / 13.3Yes
76882D structureCHEMBL494702C25H28FNO5441.4997 / 03.9Yes
78262D structureCHEMBL469668C20H29F3N2O2386.4597 / 13.9Yes
78842D structureCHEMBL253878C30H32N4OS496.6735 / 15.7No
4420352D structureCHEMBL3344465C21H25NO2S355.4964 / 14.6Yes
82002D structureBW-723C86C16H18N2OS286.3933 / 23.0Yes
82982D structureCHEMBL453631C16H17Cl2NO310.2182 / 14.8Yes
5216882D structureCHEMBL3754496C16H19FN2258.342 / 12.9Yes
86612D structureN-(4-fluorophenyl)-6-(morpholin-4-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amineC15H15FN6O314.3247 / 22.2Yes
89102D structureCHEMBL181324C12H17NO191.2742 / 12.1Yes
89462D structureCHEMBL240665C19H13F2NO2S357.3755 / 04.2Yes
90772D structureCHEMBL567246C24H28ClN5O3469.975 / 33.0Yes
92692D structureCHEMBL197870C23H25FN4OS424.5386 / 14.1Yes
94312D structureCHEMBL2397891C15H18N2O242.3222 / 11.7Yes
94352D structureCHEMBL1774078C25H32N4O3436.5566 / 13.3Yes

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