Home Research Services Publications People Teaching Job Opening Facilities News Forum Lab Only
Online Services

I-TASSER QUARK LOMETS COACH COFACTOR MetaGO MUSTER CEthreader SEGMER FG-MD ModRefiner REMO DEMO SPRING COTH BSpred ANGLOR BSP-SLIM SAXSTER ThreaDom ThreaDomEx EvoDesign GPCR-I-TASSER BindProf BindProfX SSIPe ResQ IonCom STRUM DAMpred

TM-score TM-align MM-align RNA-align NW-align LS-align EDTSurf MVP MVP-Fit SPICKER HAAD PSSpred 3DRobot MR-REX I-TASSER-MR SVMSEQ NeBcon ResPRE WDL-RF ATPbind DockRMSD DeepMSA

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

You can:

GPCR

NameMelatonin receptor type 1B
SpeciesHomo sapiens (Human)
GeneMTNR1B
SynonymMT2 receptor
mel1b receptor
Mel-1B-R
DiseaseEpilepsy
Length362
Amino acid sequenceMSENGSFANCCEAGGWAVRPGWSGAGSARPSRTPRPPWVAPALSAVLIVTTAVDVVGNLLVILSVLRNRKLRNAGNLFLVSLALADLVVAFYPYPLILVAIFYDGWALGEEHCKASAFVMGLSVIGSVFNITAIAINRYCYICHSMAYHRIYRRWHTPLHICLIWLLTVVALLPNFFVGSLEYDPRIYSCTFIQTASTQYTAAVVVIHFLLPIAVVSFCYLRIWVLVLQARRKAKPESRLCLKPSDLRSFLTMFVVFVIFAICWAPLNCIGLAVAINPQEMAPQIPEGLFVTSYLLAYFNSCLNAIVYGLLNQNFRREYKRILLALWNPRHCIQDASKGSHAEGLQSPAPPIIGVQHQADAL
UniProtP49286
Protein Data BankN/A
GPCR-HGmod modelP49286
3D structure modelThis predicted structure model is from GPCR-EXP P49286.
BioLiPN/A
Therapeutic Target DatabaseT48268
ChEMBLCHEMBL1946
IUPHAR288
DrugBankBE0000327

Known ligands

You can:

Total entries: 937
Page:  / 10 

GLASS IDMoleculeFormulaMolecular weightH-bond acceptor / donorXlogPLipinski's druglikeness
9132D structureCHEMBL2326200C22H25NO3351.4463 / 14.3Yes
4417072D structureCHEMBL3329375C20H19FN2O3354.3814 / 13.3Yes
11002D structureCHEMBL476341C24H27NO3377.4843 / 24.3Yes
11112D structureCHEMBL99502C14H17BrN2O2325.2062 / 22.8Yes
5214982D structureCHEMBL3760044C18H20N2O3312.3693 / 23.3Yes
22452D structureCHEMBL124914C14H18N2O2246.313 / 12.5Yes
23122D structureCHEMBL1088826C24H25NO3375.4683 / 14.9Yes
48342D structureSCHEMBL2299352C15H16N2O2256.3053 / 11.8Yes
48572D structureCHEMBL14453C32H36N2O4512.654 / 25.9No
50782D structureCHEMBL1774516C18H20F3NO2339.3585 / 13.6Yes
55182D structureCHEMBL184562C26H31NO2389.5392 / 16.3No
73262D structureCHEMBL562328C18H25N3O2315.4173 / 11.5Yes
80762D structureCHEMBL1823015C18H19N3O2309.3693 / 22.6Yes
96372D structureCHEMBL2112727C16H20N2O2272.3483 / 12.8Yes
126682D structureCHEMBL96562C20H19Cl2NO3392.2763 / 15.1No
4644452D structureCHEMBL3580912C15H16N2O2256.3053 / 13.1Yes
5218462D structureCHEMBL3740377C32H32F4N2O4584.6128 / 27.6No
136082D structureCHEMBL300729C13H15N3O4277.284 / 21.4Yes
146702D structureCHEMBL361854C26H33NO2391.5552 / 16.0No
146772D structureCHEMBL341705C16H22N2O2274.3643 / 12.4Yes
146792D structureCHEMBL136531C16H22N2O2274.3643 / 12.4Yes
150792D structureCHEMBL19432C14H19FN2O2266.3164 / 01.1Yes
155342D structure920317-71-1C18H21NO2283.3712 / 13.2Yes
170132D structureCHEMBL363321C18H19NO265.3561 / 13.2Yes
184342D structure17994-17-1C12H14N2O2218.2563 / 20.8Yes
189312D structureCHEMBL457807C22H24BrN3O2442.3573 / 24.0Yes
201212D structureCHEMBL1209788C33H38ClF2N3O3598.1327 / 04.8No
5533382D structure[125I]SD6C13H15IN2O2356.182 / 21.5Yes
202872D structureCHEMBL298335C13H15N3O4277.284 / 21.4Yes
207582D structureCHEMBL34729C15H18N2O2258.3212 / 22.2Yes
213532D structureCHEMBL139497C15H22N2O2262.3533 / 12.4Yes
213622D structureCHEMBL181687C25H33NO2379.5442 / 16.2No
218032D structureN-(3,3-diphenylpropyl)acetamideC17H19NO253.3451 / 13.3Yes
218092D structureCHEMBL331636C17H24N2O2288.3913 / 13.9Yes
220072D structureCHEMBL1813320C27H40N4O4484.6416 / 23.5Yes
229162D structureCHEMBL1779803C12H12FNOS237.2923 / 12.6Yes
4425782D structureCHEMBL3329371C22H33N3O2S403.5854 / 13.3Yes
236652D structure(hydroxymethylphenyl)agomelatineC22H23NO3349.433 / 23.5Yes
243502D structureCHEMBL1095196C31H33NO5499.6075 / 16.1No
248252D structureCHEMBL1097496C30H34N2O5502.6115 / 25.1No
249022D structureCHEMBL8004C18H20N2O2296.373 / 23.5Yes
256072D structure5-MeOT-N-pentanylC19H27N3O2329.4442 / 32.6Yes
273332D structureCHEMBL124783C16H22N2O2274.3643 / 13.4Yes
279422D structureCHEMBL98956C13H15BrN2O2311.1792 / 22.3Yes
280192D structureCHEMBL1760954C14H20N4O2276.344 / 20.2Yes
295922D structureCHEMBL238049C20H24N2O2324.4243 / 13.9Yes
301572D structureCHEMBL10328C21H22N2O318.421 / 13.7Yes
4667362D structureCHEMBL3580909C14H16N2O2244.2942 / 21.9Yes
312772D structureCHEMBL1223277C12H17NO3223.2723 / 11.6Yes
312802D structureN-[2-(3-Methoxyphenoxy)-1-methylethyl]acetamideC12H17NO3223.2723 / 11.6Yes
312812D structureCHEMBL1223278C12H17NO3223.2723 / 11.6Yes
319592D structureCHEMBL359576C33H30F3NO3545.6026 / 07.5No
327252D structureCHEMBL323332C13H15NO3233.2673 / 11.9Yes
328382D structureCHEMBL1223280C12H17NO2S239.3333 / 12.2Yes
328412D structureN-{2-[(3-methoxyphenyl)thio]-1-methylethyl}acetamideC12H17NO2S239.3333 / 12.2Yes
328422D structureCHEMBL1223281C12H17NO2S239.3333 / 12.2Yes
343422D structureCHEMBL1095195C34H38N2O4538.6884 / 26.7No
343772D structureCHEMBL99987C22H24N2O2348.4462 / 14.2Yes
355092D structureCHEMBL1092646C20H25NO4343.4234 / 13.3Yes
355332D structureCHEMBL3260984C19H29NO3319.4453 / 14.1Yes
358732D structureCHEMBL382439C19H26N2O2314.4292 / 13.4Yes
364572D structure920317-82-4C19H21NO3311.3813 / 13.5Yes
370242D structureCHEMBL1774527C22H23NO3349.433 / 13.0Yes
372522D structureCHEMBL7567C18H20N2O2296.373 / 13.2Yes
376752D structureCHEMBL553105C18H26N2O2302.4183 / 23.7Yes
388952D structureSCHEMBL2299672C15H18N2O2258.3213 / 12.5Yes
388972D structureSCHEMBL2296992C15H18N2O2258.3213 / 12.5Yes
388992D structureSCHEMBL2296995C15H18N2O2258.3213 / 12.5Yes
4677182D structureCHEMBL3580917C13H13N3O2243.2664 / 12.1Yes
392492D structureCHEMBL117617C23H21NO4375.4244 / 14.2Yes
392572D structureCHEMBL136564C15H21N3O2275.3523 / 21.8Yes
392582D structureCHEMBL136431C15H21N3O2275.3523 / 21.8Yes
4677912D structureCHEMBL3580924C14H16N4OS288.3693 / 22.0Yes
397232D structureN-(2,3-diphenylpropyl)acetamideC17H19NO253.3451 / 13.2Yes
400962D structureCHEMBL233516C16H22N2O2274.3642 / 12.4Yes
412052D structureCHEMBL99534C12H14N2O2218.2562 / 21.2Yes
4680052D structureCHEMBL3628489C14H15NO4261.2774 / 11.0Yes
421592D structureCHEMBL514280C24H29NO2363.5012 / 14.9Yes
427362D structureCHEMBL478438C25H27NO3389.4953 / 24.5Yes
438642D structureCHEMBL99000C14H18N2O2246.312 / 22.0Yes
439462D structureCHEMBL132802C17H19NO2269.3442 / 12.9Yes
441122D structurebeta-methylmelatoninC14H18N2O2246.312 / 21.9Yes
444032D structureCHEMBL1092647C19H23NO3313.3973 / 13.1Yes
445312D structureCHEMBL33172C21H21ClN2O352.8621 / 24.9Yes
4434592D structureCHEMBL3329369C13H17NO2219.2843 / 21.9Yes
457002D structureCHEMBL1813319C26H38N4O4470.6146 / 23.1Yes
461862D structureCHEMBL269175C20H20N2O304.3931 / 13.4Yes
4435052D structureCHEMBL3329374C14H17NO2231.2953 / 02.4Yes
466512D structure7-AzamelatoninC12H15N3O2233.2713 / 20.9Yes
469622D structureCHEMBL1091896C21H27NO3341.4513 / 14.1Yes
475262D structureCHEMBL14417C38H48N2O4596.8124 / 28.8No
479882D structureCHEMBL19123C18H26N2O2302.4183 / 02.3Yes
485402D structureCHEMBL521826C16H20N2O4304.3464 / 22.5Yes
488392D structureCHEMBL1760951C17H24N4O3332.4045 / 10.3Yes
498792D structureCHEMBL1813323C32H50N4O4554.7766 / 26.0No
511392D structureCHEMBL494566C18H21NO4315.3694 / 13.3Yes
517752D structureCHEMBL233517C20H22N2O2322.4082 / 23.7Yes
520112D structureCHEMBL125642C16H20N2O2272.3483 / 13.0Yes
526892D structureCHEMBL3219325C25H27N3O2401.512 / 24.3Yes
534422D structureCHEMBL359561C25H31N3O2405.5423 / 25.3No

yangzhanglabumich.edu | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218