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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

NameSphingosine 1-phosphate receptor 3
SpeciesHomo sapiens (Human)
GeneS1PR3
SynonymSphingosine 1-phosphate receptor Edg-3
S1P3 receptor
S1P3
S1P receptor Edg-3
S1P receptor 3
[ Show all ]
DiseaseBreast cancer
Length378
Amino acid sequenceMATALPPRLQPVRGNETLREHYQYVGKLAGRLKEASEGSTLTTVLFLVICSFIVLENLMVLIAIWKNNKFHNRMYFFIGNLALCDLLAGIAYKVNILMSGKKTFSLSPTVWFLREGSMFVALGASTCSLLAIAIERHLTMIKMRPYDANKRHRVFLLIGMCWLIAFTLGALPILGWNCLHNLPDCSTILPLYSKKYIAFCISIFTAILVTIVILYARIYFLVKSSSRKVANHNNSERSMALLRTVVIVVSVFIACWSPLFILFLIDVACRVQACPILFKAQWFIVLAVLNSAMNPVIYTLASKEMRRAFFRLVCNCLVRGRGARASPIQPALDPSRSKSSSSNNSSHSPKVKEDLPHTAPSSCIMDKNAALQNGIFCN
UniProtQ99500
Protein Data BankN/A
GPCR-HGmod modelQ99500
3D structure modelThis predicted structure model is from GPCR-EXP Q99500.
BioLiPN/A
Therapeutic Target DatabaseT11241
ChEMBLCHEMBL3892
IUPHAR277
DrugBankN/A

Known ligands

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Total entries: 2312
Page:  / 24 

GLASS IDMoleculeFormulaMolecular weightH-bond acceptor / donorXlogPLipinski's druglikeness
342D structureMLS000077136C12H11N3O6293.2358 / 1-0.1Yes
1492D structureCHEMBL325198C19H34NO3P355.4594 / 32.0Yes
1652D structureMLS000103088C17H20N2OS300.423 / 13.2Yes
3022D structureSCHEMBL2458105C27H35NO4S469.645 / 24.9Yes
3312D structureSMR000018340C20H18F3N7OS2493.52710 / 13.6Yes
5573172D structureBDBM65291C25H33FNO5P477.5137 / 31.4Yes
4612D structureSCHEMBL2948159C22H25ClO3S404.9494 / 15.1No
5573242D structureBDBM65164C22H36NO4PS441.5676 / 31.1Yes
5573262D structureBDBM65165C22H36NO4PS441.5676 / 31.1Yes
11142D structureMLS000054921C14H15NO3245.2783 / 01.3Yes
13722D structureSMR000023524C17H26N2O2290.4073 / 04.2Yes
14852D structureCHEMBL2011712C19H20N4OS352.4565 / 03.9Yes
16202D structureSCHEMBL786387C28H26F2N2O2460.5254 / 25.9No
19552D structureCHEMBL2018573C28H25F2N5O3517.5377 / 14.9No
20722D structureCHEMBL344354C13H25NO2S259.4084 / 22.2Yes
21682D structureSR-02000000242C19H15Cl2NO2360.2342 / 15.8No
23402D structureCHEMBL3126597C26H35N5O5497.5969 / 33.2Yes
29632D structureCHEMBL1950564C26H24FN3O2S461.5557 / 22.6Yes
29702D structureCHEMBL1938927C26H24FN3O2S461.5557 / 12.6Yes
5573792D structureBDBM65105C24H32NO5P445.4966 / 30.6Yes
5573822D structureBDBM65106C24H32NO5P445.4966 / 30.6Yes
34992D structureCHEMBL377828C26H29N3O3431.5366 / 23.0Yes
35672D structureCHEMBL143172C17H33NO2S315.5164 / 24.2Yes
5215532D structureCHEMBL3800120C26H32N4O6496.5649 / 33.2Yes
40692D structureSCHEMBL289923C29H30F2N2O2476.5684 / 16.6No
5215702D structureCHEMBL3797365C26H34N4O6498.589 / 33.2Yes
43882D structureCHEMBL117973C18H40NO3P349.4964 / 33.3Yes
46812D structureSCHEMBL4888322C28H28F2N4O3506.5547 / 14.9No
47382D structureSCHEMBL805697C27H24F2N2O3462.4975 / 25.3No
47732D structureSCHEMBL805715C29H29F2N3O2489.5675 / 16.0No
50862D structureCYM50199C14H12BrCl2NO2377.0593 / 05.2No
4419072D structureCHEMBL3359840C24H24N4O5448.4799 / 10.8Yes
54842D structureCHEMBL224571C23H19ClF3NO3S481.9148 / 13.1Yes
56642D structureCHEMBL3121985C26H33N3O5S499.6268 / 34.6Yes
4419202D structureCHEMBL3360364C21H20N4O2360.4176 / 13.4Yes
59692D structureCHEMBL1938943C23H16F3N3O2423.3957 / 14.6Yes
60382D structureCHEMBL2011719C19H20N4O2S368.4556 / 03.5Yes
63232D structureCHEMBL211407C21H21ClN2O4400.8596 / 14.4Yes
65982D structureCHEMBL3126596C27H34N4O5494.5928 / 34.0Yes
5216402D structureCHEMBL3797486C27H36N4O6512.6079 / 34.1No
5216512D structureCHEMBL3770278C18H19ClN4O3S406.8857 / 14.0Yes
70752D structureCHEMBL3126622C27H34N4O5494.5928 / 33.6Yes
5216562D structureCHEMBL3771073C22H24N6O3S452.5339 / 10.3Yes
4419972D structureCHEMBL3344423C22H22Cl2FN5O4510.3479 / 23.0No
73362D structureSMR000015635C16H17N3O2283.3313 / 12.2Yes
76792D structureCHEMBL196534C25H27N3O3417.5096 / 12.9Yes
80602D structureCHEMBL1950562C25H22FN3O2S447.5287 / 25.5No
4420392D structureCHEMBL3341925C23H29N2O6P460.4678 / 4-0.2Yes
83092D structureSCHEMBL2945721C21H25NO3S371.4954 / 23.7Yes
83422D structureCHEMBL2032437C29H27F3N2O3508.5418 / 14.3No
85892D structureCHEMBL1672569C25H20ClFN2O2S466.9556 / 13.6Yes
5575192D structureBDBM65262C22H31N2O6PS482.5329 / 3-1.3Yes
89572D structureCHEMBL117007C19H34NO4P371.4585 / 40.6Yes
91202D structureSCHEMBL4886369C28H29F2N3O2477.5565 / 15.4No
92562D structureCHEMBL2336069C29H35F3N2O3516.6058 / 24.6No
97872D structureCHEMBL1935579C26H32ClNO3441.9964 / 2N/AN/A
99762D structureCHEMBL2011747C26H25F3N4O3S530.5669 / 15.4No
100992D structureCHEMBL226612C20H34FN2O5P432.4737 / 42.2Yes
5575732D structureBDBM65133C26H37N2O5P488.5657 / 30.1Yes
5217302D structureCHEMBL3799923C27H39N5O5S545.69910 / 32.6No
102582D structureCHEMBL3133594C21H25N2O7P448.4129 / 4-1.3Yes
103382D structureMLS000043821C16H11ClFN5O343.7466 / 12.9Yes
106952D structureCHEMBL206940C21H21ClN2O4400.8596 / 15.0Yes
110012D structureCHEMBL334038C19H33N2O5P400.4566 / 41.3Yes
116192D structureCHEMBL2336064C26H30F4N2O3494.5319 / 23.8Yes
118952D structureMLS000090902C19H21NO4327.384 / 12.6Yes
5218012D structureCHEMBL3739440C20H31NO3333.4724 / 12.7Yes
122952D structureMLS000094258C15H10N4O2278.2714 / 00.5Yes
123082D structureMLS000051886C19H16ClN3O3369.8053 / 33.5Yes
124482D structureCHEMBL1092286C23H25FNO5PS477.4878 / 40.5Yes
5173832D structureSCHEMBL566013C24H30N4O5454.5279 / 31.9Yes
130182D structureSCHEMBL1187087C27H35N5O5509.6079 / 33.3No
131072D structureCHEMBL3121960C26H32N2O4S468.6127 / 16.7No
132122D structureCHEMBL1916399C22H15F3N4O5472.3811 / 13.2No
135062D structureCHEMBL224005C24H22F3NO3S461.4998 / 12.9Yes
138932D structureCHEMBL1651707C25H21NO4399.4465 / 12.4Yes
4593452D structureCHEMBL1087911C24H33N5O407.5625 / 14.2Yes
139882D structureCHEMBL115131C19H33NO3S355.5374 / 22.7Yes
144032D structureCHEMBL119562C15H34NO3P307.4154 / 31.6Yes
144642D structureCHEMBL2207780C26H29FN4O3S496.6018 / 12.3Yes
146972D structureCHEMBL2011740C23H21F3N4OS458.5037 / 05.6No
148592D structureTCMDC-124447C15H18N2226.3231 / 12.6Yes
5577142D structureBDBM65063C23H38NO5P439.5336 / 31.2Yes
159052D structureSCHEMBL805638C29H29F2N3O2489.5674 / 25.4No
160692D structureCHEMBL218446C38H50N2O8S694.88410 / 311.1No
160702D structureCHEMBL218445C38H50N2O8S694.88410 / 311.1No
5219612D structureCHEMBL3800019C27H34N4O6510.5919 / 33.5No
163422D structureCHEMBL1672567C25H20ClFN2O2S466.9556 / 13.6Yes
164922D structureCHEMBL118508C19H34NO5P387.4576 / 30.8Yes
165062D structureSCHEMBL2294162C25H33N3O5S487.6158 / 34.3Yes
167342D structureMLS000109722C15H19BrN2O323.2342 / 13.7Yes
172412D structureAC1M0X0OC9H11NO2S197.2523 / 12.2Yes
173662D structureSMR000016951C21H19N3O5393.3995 / 22.3Yes
5219972D structureCHEMBL3800591C27H38N4O5S530.6849 / 33.8No
178072D structureSCHEMBL4685937C22H25ClO3S404.9494 / 15.1No
179972D structureCHEMBL210301C20H21N3O4367.4057 / 13.6Yes
180862D structureSCHEMBL805679C30H31F2N3O2503.5944 / 25.9No
181752D structureBAS 09529732C16H17N3O3299.334 / 11.2Yes
181902D structureMLS000583267C23H22N2O4390.4395 / 15.5No
184672D structureSMR000092447C14H14N4O2S302.3525 / 22.0Yes

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