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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

NameOxytocin receptor
SpeciesHomo sapiens (Human)
GeneOXTR
SynonymOTR
OT-R
OT receptor
DiseaseThreatened pre-term labour
Postpartum haemorrhage
Premature ejaculation
Miscarriage
Female sexual dysfunction
[ Show all ]
Length389
Amino acid sequenceMEGALAANWSAEAANASAAPPGAEGNRTAGPPRRNEALARVEVAVLCLILLLALSGNACVLLALRTTRQKHSRLFFFMKHLSIADLVVAVFQVLPQLLWDITFRFYGPDLLCRLVKYLQVVGMFASTYLLLLMSLDRCLAICQPLRSLRRRTDRLAVLATWLGCLVASAPQVHIFSLREVADGVFDCWAVFIQPWGPKAYITWITLAVYIVPVIVLAACYGLISFKIWQNLRLKTAAAAAAEAPEGAAAGDGGRVALARVSSVKLISKAKIRTVKMTFIIVLAFIVCWTPFFFVQMWSVWDANAPKEASAFIIVMLLASLNSCCNPWIYMLFTGHLFHELVQRFLCCSASYLKGRRLGETSASKKSNSSSFVLSHRSSSQRSCSQPSTA
UniProtP30559
Protein Data BankN/A
GPCR-HGmod modelP30559
3D structure modelThis predicted structure model is from GPCR-EXP P30559.
BioLiPN/A
Therapeutic Target DatabaseT84486
ChEMBLCHEMBL2049
IUPHAR369
DrugBankBE0000844

Known ligands

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Total entries: 998
Page:  / 10 

GLASS IDMoleculeFormulaMolecular weightH-bond acceptor / donorXlogPLipinski's druglikeness
4682D structureCHEMBL285013C25H28N4O5S496.5826 / 12.1Yes
5215002D structureCHEMBL3813771C44H67N11O12S21006.2114 / 10-1.6No
24202D structureCHEMBL302029C35H39FN4O5614.7188 / 04.8No
29972D structureMLS000530432C19H21ClN2O4S2440.9576 / 13.1Yes
31302D structureAC1N0YGAC3H7NO4S153.1525 / 2-4.7Yes
34452D structure[Pip7]OTC44H68N12O12S21021.2215 / 12-2.2No
55112D structureCHEMBL1092499C18H20FN3O3345.3745 / 02.5Yes
57872D structureCHEMBL87636C41H64N14O11S2993.1714 / 12-4.5No
57912D structureCHEMBL467153C21H20N4O3376.4166 / 03.3Yes
59992D structureCHEMBL2371240C44H65N15O11S21044.2214 / 12-4.4No
62432D structureCHEMBL1643587C28H37N3O3S2527.7427 / 15.6No
70312D structureCHEMBL31986C23H22N4O3S434.5146 / 03.3Yes
70902D structureCHEMBL262384C29H29N5O7559.5797 / 11.6No
76732D structureCHEMBL24353C27H29Cl2N5O5574.4596 / 31.9No
77332D structureCHEMBL1790720C61H72N12O18S21325.4321 / 15-0.9No
93812D structureCHEMBL1817690C44H69N13O12S21036.2316 / 11-3.5No
100622D structurePhenypressinC46H65N15O11S21068.2415 / 13-4.5No
116572D structureCHEMBL281044C34H30N4O6590.6366 / 13.8No
121522D structureCHEMBL473106C17H18N2O2S2346.4635 / 03.4Yes
128812D structureCHEMBL143341C25H30N4O4450.5394 / 22.0Yes
138052D structureCHEMBL1093341C18H18N2O4326.3525 / 03.2Yes
139122D structureCHEMBL489386C18H19ClN4O3374.8256 / 02.6Yes
139402D structureCHEMBL372619C30H38N4O4518.6584 / 33.9No
139412D structureCHEMBL371008C30H38N4O4518.6584 / 33.9No
145022D structureCHEMBL32745C29H34N4O5S550.6746 / 03.2No
150322D structureCHEMBL372554C31H40N4O4532.6854 / 34.1No
155732D structureCHEMBL1779235C26H33N3O5S499.6266 / 13.4Yes
161632D structureCHEMBL287067C23H23N3O3389.4553 / 13.5Yes
174152D structureCHEMBL1093709C21H21N3O4379.4165 / 12.6Yes
185282D structureCHEMBL200682C22H21ClN2O4S444.935 / 14.5Yes
187592D structureCHEMBL284120C32H31Cl2N5O5636.536 / 33.5No
190742D structureCHEMBL2037491C27H34N4O3462.5944 / 13.4Yes
193342D structureCHEMBL1790713C73H85N11O19S21484.6621 / 153.7No
202382D structureCHEMBL194432C31H39N3O3501.6713 / 15.5No
205852D structureCHEMBL257916C26H31F3N4O4520.5538 / 24.1No
4424912D structureCHEMBL3354586C46H73N11O12S1004.2213 / 11-0.2No
209272D structureCHEMBL563771C20H17FN6O2392.3948 / 02.6Yes
216352D structure[Mpa1, D-Tic7]OTC48H67N11O12S21054.2514 / 11-0.7No
216362D structure[Mpa1, L-Tic7]OTC48H67N11O12S21054.2514 / 11-0.7No
4425162D structureCHEMBL3342790C15H11F3N4O2S368.3348 / 12.9Yes
220002D structureCHEMBL481730C22H23F3N2O2404.4336 / 04.0Yes
225002D structureCHEMBL30550C31H27F3N4O6608.5749 / 13.1No
234352D structureCHEMBL281988C34H33F3N4O5634.6569 / 04.4No
237302D structureCHEMBL2172288C66H63N9O12S1206.3415 / 74.8No
240292D structureCHEMBL379192C26H29F2N3O3469.5335 / 24.1Yes
4426222D structureCHEMBL3354600C46H67N11O12S21030.2314 / 11-0.8No
249042D structureCHEMBL458635C26H25N3O4S475.5637 / 04.3Yes
253192D structureCHEMBL1819552C39H67N13O11S2958.16515 / 12-4.4No
253492D structureCHEMBL1779406C34H39ClN4O6S667.2188 / 04.7No
259882D structureCHEMBL590099C18H18ClN5O2371.8256 / 03.3Yes
268852D structureCHEMBL2037497C30H38N4O4518.6585 / 13.5No
5581072D structureCHEMBL200329C24H25N3O5S467.547 / 24.0Yes
5581102D structureCID 136494531C24H25N3O5S467.547 / 24.0Yes
288522D structureCHEMBL319646C28H28N2O5472.5415 / 04.4Yes
296442D structureCHEMBL68816C34H37FN4O6616.698 / 03.5No
299862D structureCHEMBL456254C27H27N3O5S505.5898 / 04.3No
300022D structureCHEMBL2369845C46H65N13O11S21040.2314 / 12-2.0No
300072D structureCHEMBL411013C46H65N13O11S21040.2314 / 12-2.0No
301442D structureCHEMBL1093776C19H20N4O2336.3954 / 13.2Yes
308212D structureCHEMBL551395C21H20N6O2388.4317 / 02.9Yes
313532D structureCHEMBL474219C23H27NO4S413.5324 / 03.4Yes
318192D structureCHEMBL1819541C42H65N13O12S21008.1816 / 13-4.5No
322002D structureCHEMBL441128C46H73N11O12S21036.2814 / 110.0No
324402D structureCHEMBL286084C22H20N2O4376.4124 / 03.4Yes
327232D structureCHEMBL457998C25H23N3O3S445.5376 / 04.3Yes
5225442D structureCHEMBL3814126C44H68N12O12S21021.2215 / 11-2.4No
342982D structureCHEMBL455699C26H25F2N3O2449.5024 / 24.8Yes
4430332D structureCHEMBL3354598C49H71N11O12S1038.2313 / 110.0No
358832D structureCHEMBL1817698C44H69N13O12S21036.2316 / 13-4.4No
361662D structureCHEMBL473442C22H24ClNO2369.8892 / 04.8Yes
364382D structureCHEMBL373167C24H24N2O4S436.5265 / 03.7Yes
370572D structured[Cha4,Orn8]VPC49H69N11O11S21052.2814 / 110.5No
378292D structureCHEMBL32740C23H23N3O3389.4553 / 13.5Yes
380232D structureCHEMBL2037501C29H36N4O4504.6315 / 13.1No
380242D structureCHEMBL2037500C29H36N4O4504.6315 / 13.1No
384732D structureCHEMBL1779419C31H31ClN4O6S623.1219 / 14.1No
391462D structureCHEMBL271039C27H34N4O5494.5926 / 12.6Yes
391472D structureCHEMBL513488C27H34N4O5494.5926 / 12.6Yes
392202D structureCHEMBL105514C28H28FN3O6521.5457 / 02.8No
4432452D structureCHEMBL3354599C49H71N11O11S1022.2312 / 100.3No
397512D structureRelcovaptanC28H27Cl2N3O7S620.4988 / 23.8No
5584952D structureCHEMBL200792C21H18ClN3O4S443.9026 / 23.9Yes
398652D structureCHEMBL2037510C28H36N4O3476.6214 / 13.8Yes
5227362D structureCHEMBL3814744C44H68N12O12S21021.2215 / 11-2.4No
399842D structureCHEMBL512257C20H18N6O2374.4047 / 01.2Yes
405732D structureCHEMBL285012C27H32N4O5S524.6366 / 02.6No
411132D structureCHEMBL549494C20H17FN6O2392.3948 / 02.6Yes
414712D structureCHEMBL606976C21H23F2N5O2415.4458 / 04.0Yes
419652D structureMLS001079319C25H29N3O4S467.5846 / 23.6Yes
423182D structureCHEMBL455718C25H23F2N3O2435.4754 / 24.4Yes
442442D structureCHEMBL1817769C39H65N13O11S2956.14915 / 12-4.2No
447562D structureCHEMBL2369831C45H63N13O12S21042.215 / 13-2.9No
447622D structureCHEMBL405783C45H63N13O12S21042.215 / 13-2.9No
457532D structureCHEMBL492029C20H24N4O3368.4376 / 02.7Yes
4435232D structureCHEMBL3354585C46H73N11O12S1004.2213 / 11-0.2No
473952D structureCHEMBL2369848C48H63N13O11S31094.2915 / 12-1.5No
473962D structureCHEMBL411485C48H63N13O11S31094.2915 / 12-1.5No
483262D structureCHEMBL601929C32H37ClN6O2S605.1984 / 13.5No
488132D structureMLS000547068C22H23ClN2O4S446.9467 / 3N/AN/A
490002D structureCHEMBL590349C19H20ClN5O3401.8517 / 02.6Yes

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