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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

NameType-1 angiotensin II receptor
SpeciesHomo sapiens (Human)
GeneAGTR1
SynonymType-1 angiotensin II receptor
HAT1R
Agtr-1a
type-1A angiotensin II receptor
AT1
[ Show all ]
DiseaseMetabolic syndrome x
Myocardial infarction
Hypertension
Restenosis
Alzheimer disease
[ Show all ]
Length359
Amino acid sequenceMILNSSTEDGIKRIQDDCPKAGRHNYIFVMIPTLYSIIFVVGIFGNSLVVIVIYFYMKLKTVASVFLLNLALADLCFLLTLPLWAVYTAMEYRWPFGNYLCKIASASVSFNLYASVFLLTCLSIDRYLAIVHPMKSRLRRTMLVAKVTCIIIWLLAGLASLPAIIHRNVFFIENTNITVCAFHYESQNSTLPIGLGLTKNILGFLFPFLIILTSYTLIWKALKKAYEIQKNKPRNDDIFKIIMAIVLFFFFSWIPHQIFTFLDVLIQLGIIRDCRIADIVDTAMPITICIAYFNNCLNPLFYGFLGKKFKRYFLQLLKYIPPKAKSHSNLSTKMSTLSYRPSDNVSSSTKKPAPCFEVE
UniProtP30556
Protein Data Bank6do1, 4zud, 4yay
GPCR-HGmod modelP30556
3D structure modelThis structure is from PDB ID 6do1.
BioLiPBL0312790, BL0326733, BL0439004,BL0439005
Therapeutic Target DatabaseT74456
ChEMBLCHEMBL227
IUPHAR34
DrugBankBE0000062

Known ligands

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Total entries: 1414
Page:  / 15 

GLASS IDMoleculeFormulaMolecular weightH-bond acceptor / donorXlogPLipinski's druglikeness
1022D structureCHEMBL338434C36H41F4N5O6S747.80711 / 27.3No
5412D structureMLS000761483C20H19ClN2O338.8353 / 14.5Yes
6612D structureCHEMBL47177C33H35N7O2561.697 / 15.4No
9672D structureMLS000389682C18H15ClN4O3370.7935 / 13.6Yes
13442D structureSR-01000300690C22H22N4O3390.4434 / 22.5Yes
14052D structureCHEMBL30086C36H28N8O2604.6747 / 04.8No
15482D structureCHEMBL306216C32H33FN8O2580.6689 / 22.8No
17432D structureCHEMBL2158341C15H11N3O5S345.3299 / 01.5Yes
19852D structure137862-87-4C24H29N5O3435.5286 / 24.4Yes
19862D structurevalsartanC24H29N5O3435.5286 / 24.4Yes
21172D structureCHEMBL2158345C18H13N3O6S399.3779 / 02.6Yes
22292D structureCHEMBL30015C37H29N7O3619.6857 / 15.5No
32042D structureTASOSARTANC23H21N7O411.4696 / 13.0Yes
35382D structureCHEMBL74476C35H43N5O6S661.8187 / 25.8No
38472D structureCEP-11981C28H27N7O477.5725 / 23.9Yes
39332D structureCHEMBL1801742C29H31N7477.6165 / 16.4No
46932D structureCHEMBL282168C34H31N7O3585.6687 / 15.2No
49142D structureMLS000681499C20H15N3O8425.3538 / 11.4Yes
53292D structure3-(4-Nitro-benzyloxy)-7,8,9,10-tetrahydro-benzo[c]chromen-6-oneC20H17NO5351.3585 / 04.1Yes
54312D structureMLS002320750C27H28ClNO4465.9745 / 3N/AN/A
60432D structureMLS001206870C19H13NO7367.3137 / 03.8Yes
60832D structureCHEMBL91069C26H29N3O5463.5345 / 23.9Yes
65922D structureMLS000699844C17H14N2O5326.3085 / 02.8Yes
70542D structureCHEMBL2158321C12H9FO3S252.2595 / 12.1Yes
71672D structureSMR000160170C13H22BrN5OS376.3173 / 32.1Yes
87872D structureSCHEMBL2774146C32H24F2N4O6S630.62310 / 15.9No
5479832D structureFIMASARTANC27H31N7OS501.6536 / 13.5No
90262D structureMLS000860444C14H18N4OS290.3855 / 24.0Yes
94212D structureCHEMBL306922C34H37N7O4607.7158 / 25.7No
95672D structureMLS000923770C20H18N2O7398.3717 / 11.8Yes
95992D structureCHEMBL90513C25H20N8O448.497 / 23.7Yes
100352D structureCHEMBL124771C33H37BrFN5O6S730.658 / 26.2No
106862D structureMLS000720075C13H9N5O5315.2457 / 11.8Yes
109412D structureCHEMBL125835C27H31N5O5S537.6358 / 03.7No
110152D structureMLS001033014C14H17Cl2NO286.1962 / 04.2Yes
5217552D structureCHEMBL3734859C35H35N3O2S561.7444 / 27.9No
5217562D structureCHEMBL3735831C35H35N3O2S561.7444 / 27.9No
111422D structureCHEMBL2322442C31H33N7O519.6535 / 16.0No
5217602D structureCHEMBL3786145C63H85F12N15O211616.4437 / 19N/ANo
5217862D structurepropranololC16H21NO2259.3493 / 23.0Yes
124822D structureCHEMBL74144C35H34FN5O6S671.7449 / 25.5No
129472D structureCHEMBL122157C31H33BrFN5O6S702.5968 / 25.3No
140792D structureMLS001239249C30H34N4O3S2562.7477 / 05.5No
143612D structureCHEMBL436396C32H35BrFN5O6S716.6238 / 25.6No
143702D structureCHEMBL70868C43H55FN4O7S790.9929 / 18.9No
146042D structureCHEMBL2058856C34H33N7O2571.6856 / 26.2No
150192D structureMLS000528306C14H12N4S268.3385 / 13.1Yes
150462D structureCHEMBL125766C23H28N4O4424.5015 / 23.5Yes
150472D structureCHEMBL125937C23H28N4O4424.5015 / 23.5Yes
150962D structuredisulfiramC10H20N2S4296.5244 / 03.9Yes
155042D structureMLS001239478C29H32N4O3S2548.727 / 05.2No
155392D structureCHEMBL321313C33H37ClFN5O6S686.1968 / 26.4No
158352D structure(1Z,3Z)-1,4-bis(butylsulfonyl)buta-1,3-dieneC12H22O4S2294.4244 / 02.1Yes
171802D structureCHEMBL309165C30H32N10O2564.65410 / 21.3No
5219882D structureCHEMBL3735236C37H45N7O4S683.8729 / 25.4No
176192D structureMLS000039260C14H14N4O3286.2915 / 20.9Yes
187672D structureCHEMBL311386C34H40FN5O6S665.7818 / 24.5No
190812D structureCHEMBL2158335C18H16N2O5S2404.4558 / 02.9Yes
5220402D structureCHEMBL1716544C21H20FN3O3381.4075 / 12.4Yes
198952D structureSCHEMBL2773794C32H25F3N4O4S618.6319 / 17.2No
199572D structureCHEMBL74236C39H42FN3O6S2731.8989 / 19.2No
199692D structureCHEMBL2322443C31H26FN7O531.5956 / 15.3No
208712D structureMLS002245453C23H26N2O8458.4678 / 14.0Yes
209462D structureMLS001098424C12H12ClFN4O2S330.7627 / 22.9Yes
209622D structureMLS000723451C13H10N4O3270.2485 / 11.9Yes
210882D structureMLS000520994C16H13N5O4S2403.43110 / 24.1Yes
215772D structureCHEMBL315873C31H40N4O5S580.7445 / 26.1No
216742D structureCHEMBL73283C41H44FN3O7S2773.93510 / 18.7No
219852D structureMLS001196044C20H19NO3321.3764 / 14.4Yes
5221362D structureCHEMBL3775436C15H26ClNO3303.8274 / 3N/AN/A
5221992D structureCHEMBL3775769C15H26ClNO3303.8274 / 3N/AN/A
221652D structureMLS000094900C25H26FN5O3S495.5737 / 23.0Yes
225702D structureBDBM46978C16H17NO4S319.3755 / 24.5Yes
237922D structure4-[(2E)-2-(2,4-dimethoxybenzylidene)hydrazinyl]-2-(3,5-dimethyl-1H-pyrazol-1-yl)-6-methylpyrimidineC19H22N6O2366.4257 / 13.6Yes
249192D structureCHEMBL72409C31H35N9O549.6838 / 23.5No
252012D structureMLS001173828C15H14ClNO2275.7323 / 13.8Yes
5223282D structureCHEMBL3734819C34H33N3O4547.6555 / 35.9No
5223292D structureCHEMBL3735333C34H33N3O4547.6555 / 35.9No
255922D structureCHEMBL39542C35H26N6O546.6345 / 16.6No
255972D structureCHEMBL2158271C19H15N3O8S445.40211 / 02.1No
258492D structureSCHEMBL2775820C29H28N4O6S560.6258 / 23.8No
5580752D structureMLS000058898C13H22N2O2S270.3914 / 13.3Yes
4427152D structureCHEMBL3355127C24H27FN4O2422.5045 / 13.6Yes
272242D structureCHEMBL2203713C18H22N4S326.4624 / 22.9Yes
272782D structureMLS000390992C22H21N3O4391.4276 / 13.9Yes
275362D structureCHEMBL338123C30H36N4O4S548.7026 / 05.6No
280592D structureSMR000103373C16H17NO239.3182 / 03.8Yes
283842D structureMLS000584397C19H20N2OS2356.5024 / 05.0Yes
285602D structureMLS000698760C11H10ClN3S2283.7923 / 23.5Yes
287872D structureCHEMBL1801737C28H29N7463.5895 / 16.0No
295612D structureCHEMBL281890C34H30N7O6P-2663.63110 / 03.8No
295872D structureCHEMBL2259777C27H36F3N5O4S583.6719 / 15.6No
305602D structureSCHEMBL2774156C31H23ClN4O5S599.0587 / 16.3No
305682D structureMLS000679816C19H21N3O2S355.4563 / 34.5Yes
305832D structureMLS001116397C20H19ClN4O5S2494.9658 / 12.6Yes
306102D structureCHEMBL2337677C36H35BrN10O703.6498 / 3N/ANo
306892D structureCHEMBL70793C41H44FN3O6S725.8768 / 19.5No
308502D structureCHEMBL334300C33H38ClN5O6S668.2067 / 26.0No
5367872D structureCHEMBL3889627C23H27N5O3S453.5615 / 22.6Yes
312032D structureMLS001207850C14H12ClN3O273.723 / 12.9Yes

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