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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13

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GPCR

Name5-hydroxytryptamine receptor 1B
SpeciesHomo sapiens (Human)
GeneHTR1B
Synonym5-HT1B receptor
5-HT-1B
5-HT-1D-beta
5-HT1B
Serotonin 1D beta receptor
[ Show all ]
DiseaseChronic schizophrenics
Major depressive disorder
Migraine headaches
Mood disorder
Psychotic disorders
[ Show all ]
Length390
Amino acid sequenceMEEPGAQCAPPPPAGSETWVPQANLSSAPSQNCSAKDYIYQDSISLPWKVLLVMLLALITLATTLSNAFVIATVYRTRKLHTPANYLIASLAVTDLLVSILVMPISTMYTVTGRWTLGQVVCDFWLSSDITCCTASILHLCVIALDRYWAITDAVEYSAKRTPKRAAVMIALVWVFSISISLPPFFWRQAKAEEEVSECVVNTDHILYTVYSTVGAFYFPTLLLIALYGRIYVEARSRILKQTPNRTGKRLTRAQLITDSPGSTSSVTSINSRVPDVPSESGSPVYVNQVKVRVSDALLEKKKLMAARERKATKTLGIILGAFIVCWLPFFIISLVMPICKDACWFHLAIFDFFTWLGYLNSLINPIIYTMSNEDFKQAFHKLIRFKCTS
UniProtP28222
Protein Data Bank4iar, 6g79, 5v54
GPCR-HGmod modelP28222
3D structure modelThis structure is from PDB ID 4iar.
BioLiPBL0239857, BL0403524,BL0403525, BL0417722
Therapeutic Target DatabaseT07806
ChEMBLCHEMBL1898
IUPHAR2
DrugBankBE0000797

Known ligands

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Total entries: 1712
Page:  / 18 

GLASS IDMoleculeFormulaMolecular weightH-bond acceptor / donorXlogPLipinski's druglikeness
1732D structureCHEMBL2111779C24H25N3O2387.4834 / 13.8Yes
1772D structureCHEMBL119800C24H25N3O2387.4834 / 13.8Yes
6222D structureCHEMBL306197C25H32N2O376.5442 / 16.0No
10082D structureCHEMBL2205816C18H20N2O280.3713 / 11.8Yes
5532512D structure7-Hydroxy RisperidoneC23H27FN4O3426.4927 / 11.7Yes
13282D structureCHEMBL109839C21H34N2O330.5162 / 25.6No
13812D structureCHEMBL352181C26H30N4S430.6143 / 24.8Yes
16962D structureCHEMBL470849C25H28N4O2416.5255 / 13.8Yes
21592D structureCHEMBL81703C25H25FN2O2S436.5455 / 13.9Yes
21882D structureCHEMBL458002C29H28ClN5O2514.0265 / 24.3No
22652D structure1-(cyclohexylmethyl)pyrrolidineC11H21N167.2961 / 03.1Yes
31492D structureAC1N0YGAC3H7NO4S153.1525 / 2-4.7Yes
33312D structureCHEMBL196961C29H33N5O2S515.6767 / 04.0No
34022D structureCHEMBL1642882C18H19ClN4O2S390.8865 / 33.4Yes
39862D structureCHEMBL109360C17H24N2O2288.3913 / 12.7Yes
40372D structureCHEMBL225308C26H33N5O4479.5818 / 22.5Yes
40952D structureCHEMBL1173578C21H16ClN5O2S2469.9627 / 04.6Yes
43082D structureButanedioic acid, compd. with 5-methoxy-3-(1,2,3,6-tetrahydro-4-pyridinyl)-1H-indole (1:1)C18H22N2O5346.3836 / 4N/AN/A
45612D structureCHEMBL495161C25H30N4O2418.5415 / 13.1Yes
50632D structureBDBM50068818C32H39N5O6589.6938 / 22.9No
52552D structureSB-258719C18H30N2O2S338.514 / 03.5Yes
56732D structureAC1L1HUKC29H28ClN3O4518.014 / 25.2No
61422D structureCHEMBL144128C28H38N6O2490.6526 / 42.3Yes
62752D structureCHEMBL76237C19H22N2O3S358.4564 / 03.5Yes
4637402D structureCHEMBL3633757C26H24BrNO4494.3855 / 05.4No
5361322D structureCHEMBL3899832C22H19N5O4417.4258 / 23.6Yes
78272D structureCHEMBL469668C20H29F3N2O2386.4597 / 13.9Yes
81202D structureCHEMBL317333C26H24FN5425.5115 / 04.0Yes
82062D structureBW-723C86C16H18N2OS286.3933 / 23.0Yes
82502D structureCHEMBL2260924C15H20Br2N2O5468.1427 / 2N/AN/A
5216942D structureCHEMBL3754496C16H19FN2258.342 / 12.9Yes
88032D structureCHEMBL198488C31H33N7O519.6536 / 04.7No
90042D structurenaratriptanC17H25N3O2S335.4664 / 22.0Yes
93872D structureCHEMBL356315C27H34N6O458.615 / 33.3Yes
93892D structureCHEMBL143947C27H34N6O458.615 / 33.3Yes
95432D structureGSK163090C25H29N5O415.5414 / 13.4Yes
96992D structureCHEMBL309162C12H16N2O204.2732 / 21.2Yes
98802D structureAC-42C20H31NO301.4742 / 05.2No
101832D structureCHEMBL194206C23H30FN5O2427.5246 / 12.7Yes
102622D structureCHEMBL164111C22H26N6O390.4915 / 12.2Yes
107002D structureCHEMBL114303C28H36N6O472.6375 / 23.5Yes
107332D structureCHEMBL3287723C25H32O7444.5247 / 25.7No
109712D structureCHEMBL143952C25H30N6O2S478.6156 / 23.3Yes
110122D structureCHEMBL458200C29H36N4O2472.6335 / 04.7Yes
110562D structuretryptamineC10H12N2160.221 / 21.6Yes
112332D structureCHEMBL1241912C28H30N6O2482.5886 / 13.4Yes
116992D structurePropranolol, L-C16H21NO2259.3493 / 23.0Yes
117382D structurepropranololC16H21NO2259.3493 / 23.0Yes
125252D structureCHEMBL333341C27H34N6442.6114 / 14.1Yes
126072D structureCHEMBL162012C27H32N4O428.583 / 24.6Yes
130282D structureCHEMBL79725C24H26FN3O2407.4894 / 23.0Yes
136572D structure8-OH-DpatC16H25NO247.3822 / 14.1Yes
137932D structureCHEMBL199443C25H28N6OS460.67 / 02.7Yes
138282D structureCHEMBL82890C27H34N6O3490.6085 / 43.1Yes
139832D structureCHEMBL1289163C26H27FN4O430.5275 / 04.2Yes
142262D structure180083-23-2C32H32N4O3520.6336 / 05.6No
154762D structureCHEMBL2205829C19H19NO3309.3654 / 12.2Yes
155992D structureCHEMBL246598C28H33N3O3459.595 / 04.8Yes
166302D structureCHEMBL351036C26H29ClN4S465.0563 / 25.4No
166832D structureCHEMBL282229C30H32N4O4512.617 / 05.2No
167752D structurePipamperoneC21H30FN3O2375.4885 / 12.0Yes
172742D structureCHEMBL147546C29H37N7O499.6635 / 23.6Yes
174292D structureCHEMBL83617C25H26FN3O2419.54 / 23.0Yes
185092D structureSCHEMBL2881638C27H34N4O430.5964 / 15.1No
186492D structureCHEMBL345657C23H27N7401.5185 / 21.9Yes
190712D structureCHEMBL282693C28H31N5O3485.5887 / 25.0Yes
191142D structureCHEMBL162771C26H36N4O420.6013 / 24.6Yes
195522D structureCHEMBL106807C24H31ClN4O2442.9885 / 03.9Yes
200922D structureCHEMBL1631541C26H31N5O429.5684 / 13.8Yes
202102D structureCHEMBL297660C17H24N2256.3931 / 13.6Yes
203232D structureCHEMBL423212C24H30N6S434.6065 / 13.7Yes
207392D structureCHEMBL350153C28H36N4O2460.6224 / 14.3Yes
208132D structureCHEMBL509314C51H60F2N6O2827.0786 / 411.0No
211482D structureSCHEMBL3825498C23H32N2O2S400.5814 / 04.9Yes
211582D structureCHEMBL114012C23H32N2O2S400.5814 / 04.9Yes
217872D structureCHEMBL357034C15H22N2230.3551 / 23.2Yes
220222D structureCHEMBL239596C25H29ClN4O2452.9836 / 04.8Yes
225532D structureCHEMBL283036C19H19F3N4360.3846 / 13.6Yes
233822D structureCHEMBL309872C25H26ClN3O2435.9523 / 23.5Yes
235662D structureCHEMBL450852C44H44F2N6O2726.8736 / 47.2No
238002D structureCHEMBL191619C23H25Cl2N3O430.3734 / 05.2No
242892D structureCHEMBL2181168C21H24IN3O461.3474 / 05.1No
245362D structureCHEMBL511279C26H28F2N4O2466.5337 / 04.5Yes
248102D structurelysergolC16H18N2O254.3332 / 22.2Yes
248132D structureLysergoleC16H18N2O254.3332 / 22.2Yes
5366212D structure2-ChloroadenosineC10H12ClN5O4301.6878 / 4-0.1Yes
251322D structureCHEMBL329280C28H31FN6O486.5954 / 13.4Yes
260222D structureLISURIDEC20H26N4O338.4552 / 22.7Yes
260562D structureS-(-)-LisurideC20H26N4O338.4552 / 22.7Yes
260842D structureAC1L1H1TC20H26N4O338.4552 / 22.7Yes
262892D structureCHEMBL600053C18H18FNO283.3463 / 12.5Yes
5533952D structureRauwolscineC21H26N2O3354.454 / 22.9Yes
265792D structureYohimbineC21H26N2O3354.454 / 22.9Yes
266302D structureCHEBI:48565C21H26N2O3354.454 / 22.9Yes
268022D structureCHEMBL69562C19H28N2284.4471 / 15.0Yes
270322D structureCHEMBL116153C25H28F2N6450.5386 / 13.8Yes
270502D structureSB-357134C17H18Br2FN3O3S523.2157 / 23.4No
270862D structureCHEMBL445651C20H20FN3O2353.3975 / 13.3Yes
271722D structureCHEMBL2203713C18H22N4S326.4624 / 22.9Yes
273302D structureCHEMBL372651C28H27N7O477.5726 / 13.5Yes

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