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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

NameVasopressin V1a receptor
SpeciesHomo sapiens (Human)
GeneAVPR1A
SynonymV1aR
AVPR1
Antidiuretic hormone receptor 1a
AVPR V1a
V1A receptor
[ Show all ]
DiseaseSeptic shock
Localisation
Infertility
Hyponatraemia
Hypertension
[ Show all ]
Length418
Amino acid sequenceMRLSAGPDAGPSGNSSPWWPLATGAGNTSREAEALGEGNGPPRDVRNEELAKLEIAVLAVTFAVAVLGNSSVLLALHRTPRKTSRMHLFIRHLSLADLAVAFFQVLPQMCWDITYRFRGPDWLCRVVKHLQVFGMFASAYMLVVMTADRYIAVCHPLKTLQQPARRSRLMIAAAWVLSFVLSTPQYFVFSMIEVNNVTKARDCWATFIQPWGSRAYVTWMTGGIFVAPVVILGTCYGFICYNIWCNVRGKTASRQSKGAEQAGVAFQKGFLLAPCVSSVKSISRAKIRTVKMTFVIVTAYIVCWAPFFIIQMWSVWDPMSVWTESENPTITITALLGSLNSCCNPWIYMFFSGHLLQDCVQSFPCCQNMKEKFNKEDTDSMSRRQTFYSNNRSPTNSTGMWKDSPKSSKSIKFIPVST
UniProtP37288
Protein Data BankN/A
GPCR-HGmod modelP37288
3D structure modelThis predicted structure model is from GPCR-EXP P37288.
BioLiPN/A
Therapeutic Target DatabaseT79232
ChEMBLCHEMBL1889
IUPHAR366
DrugBankBE0000165

Known ligands

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Total entries: 1158
Page:  / 12 

GLASS IDMoleculeFormulaMolecular weightH-bond acceptor / donorXlogPLipinski's druglikeness
682D structureCHEMBL245072C44H44F3N5O5779.8619 / 15.8No
5359112D structureSCHEMBL256565C25H29ClF3N5O5S604.04210 / 24.5No
29962D structureMLS000530432C19H21ClN2O4S2440.9576 / 13.1Yes
48222D structurebenzazepine derivative, 16C27H28ClN3O2461.993 / 15.1No
52082D structureCHEMBL430841C35H32ClN3O2562.113 / 17.0No
55102D structureCHEMBL1092499C18H20FN3O3345.3745 / 02.5Yes
62452D structureCHEMBL1643587C28H37N3O3S2527.7427 / 15.6No
68292D structureBDBM50075728C75H86N14O181471.5920 / 151.6No
77342D structureCHEMBL1790720C61H72N12O18S21325.4321 / 15-0.9No
77442D structureCHEMBL432009C36H34ClN3O2576.1373 / 17.4No
85762D structureCHEMBL432973C36H39FN4O3594.7315 / 25.6No
93782D structureCHEMBL1817690C44H69N13O12S21036.2316 / 11-3.5No
96602D structureCHEMBL102311C30H30N2O3466.5813 / 16.2No
100602D structurePhenypressinC46H65N15O11S21068.2415 / 13-4.5No
108262D structureCHEMBL397189C36H46N4O4598.7885 / 05.6No
5217842D structurepropranololC16H21NO2259.3493 / 23.0Yes
119912D structureCHEMBL1837031C20H20ClN5O381.8645 / 02.6Yes
121512D structureCHEMBL473106C17H18N2O2S2346.4635 / 03.4Yes
128782D structureCHEMBL143341C25H30N4O4450.5394 / 22.0Yes
139132D structureCHEMBL489386C18H19ClN4O3374.8256 / 02.6Yes
4422072D structureCHEMBL3416862C23H23NO2345.4422 / 14.3Yes
5363732D structureCHEMBL3954357C21H23ClF3N5O5S2582.0111 / 22.9No
151312D structureCHEMBL393754C25H32ClN3O3457.9994 / 23.3Yes
174112D structureCHEMBL583082C29H37N3O6S3619.8110 / 14.0No
180122D structureCHEMBL321656C40H42N4O3626.8014 / 26.7No
184172D structureCHEMBL159856C28H23ClN2O2S487.0143 / 16.8No
185292D structureCHEMBL200682C22H21ClN2O4S444.935 / 14.5Yes
193332D structureCHEMBL1790713C73H85N11O19S21484.6621 / 153.7No
195182D structureCHEMBL1837016C20H20F3N5387.417 / 04.0Yes
201102D structureCHEMBL1085624C35H32ClNOS550.1572 / 010.1No
4424902D structureCHEMBL3354586C46H73N11O12S1004.2213 / 11-0.2No
5365032D structureCHEMBL3964694C22H21Cl2F3N6O4561.3438 / 42.6No
217412D structureTerlipressinC52H74N16O15S21227.3819 / 16-5.8No
220012D structureCHEMBL481730C22H23F3N2O2404.4336 / 04.0Yes
5221052D structureCHEMBL3775436C15H26ClNO3303.8274 / 3N/AN/A
5221882D structureCHEMBL3775769C15H26ClNO3303.8274 / 3N/AN/A
224912D structureCHEMBL1807276C24H28ClFN2O3446.9474 / 34.3Yes
236992D structureCHEMBL1774004C25H34ClN3O4S508.0746 / 24.5No
237272D structureCHEMBL2172288C66H63N9O12S1206.3415 / 74.8No
243382D structureCHEMBL1837026C22H25N5O3407.4747 / 12.0Yes
4426242D structureCHEMBL3354600C46H67N11O12S21030.2314 / 11-0.8No
248872D structureCHEMBL93603C32H27ClFN3O3556.0345 / 15.4No
249052D structureCHEMBL458635C26H25N3O4S475.5637 / 04.3Yes
5533852D structureLysipressinC46H65N13O12S21056.2216 / 13-3.9No
253172D structureCHEMBL1819552C39H67N13O11S2958.16515 / 12-4.4No
253502D structureCHEMBL1779406C34H39ClN4O6S667.2188 / 04.7No
258362D structureCHEMBL1837038C22H23ClN6O2438.9166 / 02.7Yes
259862D structureCHEMBL590099C18H18ClN5O2371.8256 / 03.3Yes
269142D structureCHEMBL413711C33H35N3O4537.664 / 15.5No
269872D structureCHEMBL372766C25H18F2N2O400.4293 / 04.7Yes
271742D structureCHEMBL2203713C18H22N4S326.4624 / 22.9Yes
5581082D structureCHEMBL200329C24H25N3O5S467.547 / 24.0Yes
5581092D structureCID 136494531C24H25N3O5S467.547 / 24.0Yes
289802D structureCHEMBL1773999C20H25ClN2O4S424.945 / 23.9Yes
298382D structureCHEMBL572754C30H43N3O7S2621.80810 / 13.4No
4428332D structureCHEMBL3416877C21H18ClN3O3395.8433 / 23.3Yes
300002D structureCHEMBL2369845C46H65N13O11S21040.2314 / 12-2.0No
300052D structureCHEMBL411013C46H65N13O11S21040.2314 / 12-2.0No
304712D structureCHEMBL86936C32H37N5O2523.6815 / 05.1No
308202D structureCHEMBL551395C21H20N6O2388.4317 / 02.9Yes
309762D structureCHEMBL244389C40H44F3N5O5731.8179 / 15.1No
310252D structureCHEMBL232104C28H33N7O4S563.6779 / 02.2No
314692D structureCHEMBL1084008C26H30N2O2402.5382 / 15.6No
315212D structureCHEMBL389363C34H34N2O6566.6546 / 05.7No
318222D structureCHEMBL1819541C42H65N13O12S21008.1816 / 13-4.5No
319492D structureCHEMBL314344C27H18ClF4N3O2527.9046 / 15.3No
5368222D structureSCHEMBL2443405C24H18Cl2F3N3O2508.3226 / 16.1No
330482D structurememantineC12H21N179.3071 / 13.3Yes
335022D structureUNII-7W7511NPF8C20H20N2O3S368.4516 / 11.8Yes
338152D structureCHEMBL334777C32H28N2O4S536.6465 / 26.0No
338172D structureCHEMBL128688C32H28N2O4S536.6465 / 26.0No
340092D structureCHEMBL1807278C21H24Cl2N2O3423.3343 / 33.8Yes
340912D structureCHEMBL432375C30H34N4O466.6294 / 16.3No
5368832D structureSCHEMBL6928123C22H17Cl2F3N6O4557.31110 / 23.9No
4430312D structureCHEMBL3354598C49H71N11O12S1038.2313 / 110.0No
346782D structureCHEMBL87455C32H38N4O494.6834 / 07.1No
347432D structureCHEMBL575359C27H30ClN3O3S2544.1256 / 14.5No
352692D structureCHEMBL96731C32H29N3O2S519.6634 / 15.5No
352712D structureCHEMBL329903C32H29N3O2S519.6634 / 15.5No
352722D structureCHEMBL327365C32H29N3O2S519.6634 / 15.5No
355082D structureCHEMBL131439C31H28N2O5S2572.6946 / 25.4No
358812D structureCHEMBL1817698C44H69N13O12S21036.2316 / 13-4.4No
360022D structureCHEMBL576147C27H31ClN4O3S2559.146 / 24.4No
364392D structureCHEMBL373167C24H24N2O4S436.5265 / 03.7Yes
367022D structureCHEMBL1837020C20H22ClN5367.8814 / 03.7Yes
368552D structureCHEMBL318083C35H39FN4O3582.725 / 25.5No
372112D structureCHEMBL245115C44H47F6N5O5839.8812 / 17.0No
375942D structureCHEMBL1837019C21H25N5347.4664 / 03.4Yes
4431842D structureCHEMBL3416881C25H26ClN3O3451.9513 / 03.0Yes
384742D structureCHEMBL1779419C31H31ClN4O6S623.1219 / 14.1No
5226852D structureCHEMBL3736433C14H21BN2O2260.1444 / 2N/AN/A
4432462D structureCHEMBL3354599C49H71N11O11S1022.2312 / 100.3No
397472D structureRelcovaptanC28H27Cl2N3O7S620.4988 / 23.8No
5584942D structureCHEMBL200792C21H18ClN3O4S443.9026 / 23.9Yes
399852D structureCHEMBL512257C20H18N6O2374.4047 / 01.2Yes
5370262D structureSCHEMBL255943C24H22ClF6N5O5609.9112 / 33.6No
411142D structureCHEMBL549494C20H17FN6O2392.3948 / 02.6Yes
413942D structureCHEMBL1807281C23H26Cl2N2O3449.3723 / 34.4Yes
414692D structureCHEMBL606976C21H23F2N5O2415.4458 / 04.0Yes
419662D structureMLS001079319C25H29N3O4S467.5846 / 23.6Yes

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