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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 1E
SpeciesHomo sapiens (Human)
GeneHTR1E
Synonym5-HT-1E
5-HT1E
5-hydroxytryptamine (serotonin) receptor 1E, G protein-coupled
5-HT1Ealpha
Serotonin receptor 1E
[ Show all ]
DiseaseN/A
Length365
Amino acid sequenceMNITNCTTEASMAIRPKTITEKMLICMTLVVITTLTTLLNLAVIMAIGTTKKLHQPANYLICSLAVTDLLVAVLVMPLSIIYIVMDRWKLGYFLCEVWLSVDMTCCTCSILHLCVIALDRYWAITNAIEYARKRTAKRAALMILTVWTISIFISMPPLFWRSHRRLSPPPSQCTIQHDHVIYTIYSTLGAFYIPLTLILILYYRIYHAAKSLYQKRGSSRHLSNRSTDSQNSFASCKLTQTFCVSDFSTSDPTTEFEKFHASIRIPPFDNDLDHPGERQQISSTRERKAARILGLILGAFILSWLPFFIKELIVGLSIYTVSSEVADFLTWLGYVNSLINPLLYTSFNEDFKLAFKKLIRCREHT
UniProtP28566
Protein Data BankN/A
GPCR-HGmod modelP28566
3D structure modelThis predicted structure model is from GPCR-EXP P28566.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL2182
IUPHAR4
DrugBankBE0000476

Known ligands

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Total entries: 501
Page:  / 6 

GLASS IDMoleculeFormulaMolecular weightH-bond acceptor / donorXlogPLipinski's druglikeness
352D structureMLS000077136C12H11N3O6293.2358 / 1-0.1Yes
10322D structureCHEMBL2205816C18H20N2O280.3713 / 11.8Yes
5532502D structure7-Hydroxy RisperidoneC23H27FN4O3426.4927 / 11.7Yes
14692D structure4365 CTC14H20N2O232.3272 / 12.7Yes
22582D structure1-(cyclohexylmethyl)pyrrolidineC11H21N167.2961 / 03.1Yes
52512D structureSB-258719C18H30N2O2S338.514 / 03.5Yes
56802D structureAC1L1HUKC29H28ClN3O4518.014 / 25.2No
62732D structureCHEMBL76237C19H22N2O3S358.4564 / 03.5Yes
4637322D structureCHEMBL3633757C26H24BrNO4494.3855 / 05.4No
5361222D structureCHEMBL3899832C22H19N5O4417.4258 / 23.6Yes
81962D structureBW-723C86C16H18N2OS286.3933 / 23.0Yes
5216962D structureCHEMBL3754496C16H19FN2258.342 / 12.9Yes
5532912D structurenaratriptanC17H25N3O2S335.4664 / 22.0Yes
104392D structureSB 204070 hydrochlorideC19H27ClN2O4382.8856 / 13.5Yes
107362D structureCHEMBL3287723C25H32O7444.5247 / 25.7No
110682D structuretryptamineC10H12N2160.221 / 21.6Yes
118932D structureMLS000090902C19H21NO4327.384 / 12.6Yes
136712D structure8-OH-DpatC16H25NO247.3822 / 14.1Yes
142272D structure180083-23-2C32H32N4O3520.6336 / 05.6No
148582D structureTCMDC-124447C15H18N2226.3231 / 12.6Yes
154812D structureCHEMBL2205829C19H19NO3309.3654 / 12.2Yes
167932D structurePipamperoneC21H30FN3O2375.4885 / 12.0Yes
181882D structureMLS000583267C23H22N2O4390.4395 / 15.5No
211472D structureSCHEMBL3825498C23H32N2O2S400.5814 / 04.9Yes
211542D structureCHEMBL114012C23H32N2O2S400.5814 / 04.9Yes
225512D structureCHEMBL283036C19H19F3N4360.3846 / 13.6Yes
231752D structure1-(4-iodo-2,5-dimethoxyphenyl)propan-2-amineC11H16INO2321.1583 / 12.5Yes
242832D structureCHEMBL2181168C21H24IN3O461.3474 / 05.1No
248062D structurelysergolC16H18N2O254.3332 / 22.2Yes
248152D structureLysergoleC16H18N2O254.3332 / 22.2Yes
5366242D structure2-ChloroadenosineC10H12ClN5O4301.6878 / 4-0.1Yes
262882D structureCHEMBL600053C18H18FNO283.3463 / 12.5Yes
5533942D structureRauwolscineC21H26N2O3354.454 / 22.9Yes
265832D structureYohimbineC21H26N2O3354.454 / 22.9Yes
266312D structureCHEBI:48565C21H26N2O3354.454 / 22.9Yes
270382D structureSB-357134C17H18Br2FN3O3S523.2157 / 23.4No
275142D structureCHEMBL2432063C19H29N271.4481 / 04.7Yes
301972D structureSCHEMBL14542291C22H21NO3347.4143 / 04.3Yes
5482372D structureCHEMBL3959210C14H18ClN5O3339.787 / 30.3Yes
330382D structurememantineC12H21N179.3071 / 13.3Yes
403142D structureAripiprazoleC23H27Cl2N3O2448.3884 / 14.6Yes
408452D structureMLS000058422C15H19ClN2O3310.7784 / 13.4Yes
410822D structureCHEMBL476838C23H29FN2O5432.4927 / 13.9Yes
424762D structureCHEMBL2432039C20H23N277.4111 / 12.7Yes
429292D structure3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indoleC13H14N2198.2691 / 21.8Yes
440002D structureCHEMBL2432060C21H26FN311.4442 / 04.8Yes
457852D structure23981-80-8C14H14O3230.2633 / 13.3Yes
469842D structureCHEMBL277452C34H40N6O2564.7344 / 63.6No
474802D structureCHEMBL2432051C21H27NO3341.4514 / 13.3Yes
525572D structureCHEMBL590615C19H20FNO297.3733 / 13.0Yes
4695152D structureCHEMBL3609143C29H29NO4455.5545 / 05.4No
538062D structure{4-[(3-fluorophenyl)methoxy]phenyl}methanamine hydrochlorideC14H15ClFNO267.7283 / 2N/AN/A
4696252D structureCHEMBL3608451C27H27NO4429.5165 / 05.1No
556512D structurefenfluramineC12H16F3N231.2624 / 13.4Yes
562942D structureMLS000861141C19H15N3O3333.3475 / 04.0Yes
563262D structureCHEMBL2205833C17H18N2O266.3443 / 11.3Yes
570402D structureSMR000078951C21H22N2O3350.4183 / 03.6Yes
5485382D structureAripiprazole lauroxilC36H51Cl2N3O4660.7216 / 010.0No
5232152D structureCHEMBL3770342C14H18BrN5336.2372 / 32.3Yes
579792D structureCHEMBL2432053C19H22N2O294.3983 / 02.0Yes
600502D structureMLS000048662C18H27N4O3P378.4136 / 01.5Yes
605062D structureCHEMBL253597C21H20N2O3347.4024 / 03.2Yes
622022D structurespiperoneC23H26FN3O2395.4785 / 13.0Yes
625242D structureSMR000025686C23H24ClN3O3425.9134 / 24.3Yes
631782D structurephenylpropanolamineC9H13NO151.2092 / 20.8Yes
635772D structureMLS000033110C12H11N5O2S289.3134 / 01.4Yes
690312D structuremethylphenidateC14H19NO2233.3113 / 10.2Yes
691492D structureCHEMBL137781C21H25N3O335.4512 / 13.2Yes
691762D structureCHEMBL343755C21H25N3O335.4512 / 13.2Yes
691892D structureCHEMBL138989C21H25N3O335.4512 / 13.2Yes
696412D structureCHEMBL2432049C18H22N2266.3882 / 12.8Yes
696992D structureCHEMBL282971C23H26ClN3O3S2492.0497 / 15.2No
697092D structureCHEMBL29433C23H26ClN3O3S2492.0497 / 15.2No
702052D structureCHEMBL3104091C20H20N2288.3941 / 03.9Yes
709062D structureCHEMBL1651208C27H24ClNO4461.9424 / 15.5No
720882D structureMLS000044646C10H7F3N2O3S292.2328 / 01.5Yes
731592D structureCHEMBL1258452C18H28N2O3320.4335 / 13.1Yes
737362D structureFASDKYOPVNHBLU-UHFFFAOYSA-NC10H17N3S211.3274 / 21.9Yes
765762D structureZacoprideC15H20ClN3O2309.7944 / 21.7Yes
4723382D structureCHEMBL3609142C31H35NO4485.6245 / 07.0No
767332D structureMLS000058692C13H7ClN6S2346.8117 / 04.2Yes
5597682D structureMLS000064957C17H16N2O3S328.3865 / 22.9Yes
804462D structureCHEMBL282829C20H24N4320.443 / 13.5Yes
819862D structureSMR000102200C21H28N2O3356.4665 / 13.7Yes
836172D structureCHEMBL2205813C21H25NO3339.4354 / 12.8Yes
836892D structureMLS000086722C17H25N3O2S335.4664 / 12.9Yes
838852D structureKetanserinC22H22FN3O3395.4345 / 12.6Yes
5380712D structureCHEMBL286739C13H16ClN5O3325.7537 / 40.2Yes
847302D structureCHEMBL2024087C14H20N2O2248.3264 / 20.9Yes
864802D structure4'-AminopropiophenoneC9H11NO149.1932 / 11.7Yes
872172D structureSMR000102159C19H23FN2O2330.4035 / 03.4Yes
873582D structureBDBM31035C23H25N3O6439.4686 / 22.3Yes
881502D structureMLS000392370C22H17Cl2NO3414.2823 / 16.0No
896762D structureCHEMBL17828C35H42N6O2578.7614 / 64.0No
897422D structureBrolamfetamineC11H16BrNO2274.1583 / 12.6Yes
901592D structureSMR000019649C25H29N3O4S467.5847 / 14.1Yes
909332D structureCHEMBL1643900C19H22FN283.392 / 13.9Yes
911622D structureCHEMBL1258722C23H30N4O2394.5194 / 03.8Yes
914512D structureCHEMBL1643901C19H22FN283.392 / 03.9Yes
4743662D structureCHEMBL3609146C25H23NO4401.4625 / 14.4Yes

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