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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

NameB1 bradykinin receptor
SpeciesHomo sapiens (Human)
GeneBDKRB1
Synonymkinin B1 receptor
bradykinin receptor
BKR1
BK-1 receptor
B1R
[ Show all ]
DiseaseDiabetic macular edema
Rheumatoid arthritis
Pain
Osteoarthritis
Length353
Amino acid sequenceMASSWPPLELQSSNQSQLFPQNATACDNAPEAWDLLHRVLPTFIISICFFGLLGNLFVLLVFLLPRRQLNVAEIYLANLAASDLVFVLGLPFWAENIWNQFNWPFGALLCRVINGVIKANLFISIFLVVAISQDRYRVLVHPMASRRQQRRRQARVTCVLIWVVGGLLSIPTFLLRSIQAVPDLNITACILLLPHEAWHFARIVELNILGFLLPLAAIVFFNYHILASLRTREEVSRTRCGGRKDSKTTALILTLVVAFLVCWAPYHFFAFLEFLFQVQAVRGCFWEDFIDLGLQLANFFAFTNSSLNPVIYVFVGRLFRTKVWELYKQCTPKSLAPISSSHRKEIFQLFWRN
UniProtP46663
Protein Data BankN/A
GPCR-HGmod modelP46663
3D structure modelThis predicted structure model is from GPCR-EXP P46663.
BioLiPN/A
Therapeutic Target DatabaseT58589
ChEMBLCHEMBL4308
IUPHAR41
DrugBankBE0005831

Known ligands

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Total entries: 1048
Page:  / 11 

GLASS IDMoleculeFormulaMolecular weightH-bond acceptor / donorXlogPLipinski's druglikeness
3482D structureCHEMBL603907C20H20ClF2N7O2463.8748 / 23.1Yes
6692D structureCHEMBL210427C27H25Cl2N3O4S558.4746 / 25.8No
9512D structureCHEMBL206982C26H26F2N4O5S544.57410 / 12.9No
22072D structureCHEMBL243432C21H17BrN6O3481.315 / 42.3Yes
29862D structureCHEMBL208247C26H26F2N4O3480.5168 / 13.6Yes
41452D structureCHEMBL375288C24H20Cl2N4O3483.3496 / 25.4No
42542D structureCHEMBL387331C21H20F2N2O4402.3986 / 22.4Yes
47702D structureCHEMBL589819C24H21ClF2N6O5546.91610 / 24.4No
49502D structureCHEMBL452238C33H42ClN3O5S628.2257 / 16.0No
50212D structureCHEMBL380260C27H32Cl2N4O4S579.5377 / 34.5No
51952D structureCHEMBL2311187C47H75N13O111002.2114 / 11-4.1No
51962D structureCHEMBL2369827C47H75N13O11998.19714 / 11-4.1No
51982D structureCHEMBL413382C47H75N13O11998.19714 / 11-4.1No
62222D structureCHEMBL299164C34H41N7O2579.7496 / 25.4No
63122D structureCHEMBL591110C20H23N5O3381.4365 / 30.7Yes
63272D structuredes-Arg10-KallidinC50H73N13O111032.2114 / 11-3.8No
65992D structureCHEMBL232750C21H17Cl2F4N3O4522.2789 / 24.0No
74562D structureCHEMBL1939763C22H23N3O4S425.5035 / 21.8Yes
76102D structureCHEMBL208210C31H28F2N4O3542.5878 / 15.4No
83562D structureCHEMBL221998C24H20Cl2N4O3483.3496 / 25.4No
92442D structureSafotibantC25H34N4O5S502.637 / 11.6No
100672D structureCHEMBL453338C31H38N2O4S534.7155 / 15.0No
5575782D structureSCHEMBL10147804C24H19ClF2N6O5544.911 / 22.4No
5480012D structureCHEMBL3980627C24H19ClF2N6O5544.911 / 22.4No
108102D structureCHEMBL447392C33H43ClN4O5S643.248 / 15.0No
109402D structureCHEMBL227828C29H29N3O4S515.6286 / 33.4No
120102D structureCHEMBL1939920C23H25N3O5S455.5296 / 31.0Yes
120242D structureCHEMBL516783C21H17FN2O4S412.4356 / 23.6Yes
120752D structureCHEMBL426681C32H30F2N4O3556.6148 / 15.1No
122162D structureCHEMBL390916C23H24Cl2N6O2487.3855 / 34.1Yes
129022D structure913064-47-8C29H29ClN4O2501.0274 / 04.4No
129672D structureCHEMBL241935C24H26BrClN6O2545.8665 / 24.2No
132752D structureCHEMBL206246C26H39N5O3S501.696 / 22.3No
148842D structureCHEMBL381372C28H36F3N3O4S567.6689 / 23.6No
150602D structureCHEMBL507168C26H32Cl2N2O5S555.5116 / 34.0No
151242D structureCHEMBL1210753C32H36F3N3O3S599.7138 / 36.0No
151712D structureCHEMBL386794C36H48Cl2N5O5S+733.777 / 15.2No
152262D structureCHEMBL470693C21H17ClN2O4S428.8875 / 24.1Yes
158502D structureCHEMBL272491C21H23F2NO4391.4156 / 23.8Yes
159762D structureCHEMBL2372168C50H72N18O111101.2416 / 12-3.8No
159822D structureCHEMBL444431C30H32Cl2N4O5S631.5697 / 34.5No
164652D structureCHEMBL244284C27H33BrClN7O2602.9626 / 24.2No
171352D structureCHEMBL2440659C15H11FN4O2S330.3377 / 12.4Yes
171722D structureCHEMBL2372142C50H79N15O111066.2814 / 12-3.6No
176292D structureCHEMBL1777968C28H36N4O5S540.6797 / 22.1No
177932D structureCHEMBL379259C25H30Cl2N4O4S553.4997 / 34.0No
182552D structureCHEMBL412762C33H35N3O5S585.7197 / 24.0No
182642D structureCHEMBL1939770C22H22N4O5S454.5016 / 30.3Yes
192292D structureCHEMBL1835757C32H32N2O3492.6194 / 15.4No
192312D structureCHEMBL1934259C32H32N2O3492.6194 / 15.4No
195732D structureCHEMBL216618C49H69N15O12S1092.2416 / 13-5.6No
209262D structureCHEMBL1956869C34H46Cl2N5O5S+707.7328 / 14.6No
209672D structureCHEMBL2016601C33H38Cl2N4O3S641.6526 / 16.7No
217992D structureCHEMBL390272C26H19BrN6O3543.3815 / 44.0No
226472D structureCHEMBL3038098C59H91N19O13S1306.5618 / 15-5.9No
226982D structureCHEMBL381366C29H38F3N3O3S565.6968 / 24.7No
227942D structure8-Leu-9-des-arg-BKC41H63N11O10870.02212 / 9-3.6No
233202D structureCHEMBL1788318C35H48N6O2584.8095 / 26.3No
233212D structureCHEMBL1744082C35H48N6O2584.8095 / 26.3No
243102D structureCHEMBL207000C28H26F2N4O3504.5388 / 13.7No
246982D structureCHEMBL1956722C36H48Cl2N5O6S+749.7698 / 14.3No
251132D structureCHEMBL2087036C23H26Cl2N4O3S509.4465 / 12.9No
255402D structureCHEMBL2087415C23H29ClN4O4S493.0196 / 11.9Yes
262052D structureRS 39604C26H36ClN3O6S554.0999 / 23.1No
270592D structureCHEMBL1834749C31H33N5O2507.6385 / 14.3No
281792D structureCHEMBL234296C22H22F4N4O434.4398 / 24.2Yes
287762D structureCHEMBL1956857C36H45Cl2F3N6O8S849.74515 / 4N/ANo
294292D structureCHEMBL2372164C50H72N17O11+1087.2315 / 12-4.1No
296562D structureCHEMBL389054C30H34F3N3O4S589.6749 / 34.5No
303132D structureCHEMBL222156C35H45Cl2N7O5S746.7498 / 34.0No
5582202D structureSCHEMBL10182621C26H23ClF2N8O4584.96911 / 22.8No
5482222D structureCHEMBL3892284C26H23ClF2N8O4584.96911 / 22.8No
313062D structureCHEMBL256793C21H23F2NO4391.4156 / 23.7Yes
313142D structureCHEMBL487444C23H24N4O4S452.5296 / 42.9Yes
319672D structureCHEMBL1939949C23H31ClN4O4S495.0356 / 12.1Yes
319972D structureCHEMBL609157C23H21ClF2N8O4546.9210 / 24.0No
331182D structureCHEMBL1835766C31H32N4O2492.6234 / 14.7Yes
332842D structureCHEMBL498393C23H31N5O3S457.5935 / 31.4Yes
334472D structureCHEMBL388031C22H21F5N4O452.4299 / 24.3Yes
339872D structureCHEMBL160547C31H28ClN5O4S602.1066 / 33.7No
341862D structureCHEMBL1777880C23H34N4O4S462.6096 / 20.9Yes
359502D structureCHEMBL205093C34H46Cl2N6O5S721.7399 / 23.8No
366142D structureCHEMBL598868C15H12ClF2N7O2395.7558 / 31.7Yes
373542D structureCHEMBL2372151C44H61N11O11920.03813 / 10-3.7No
5584152D structureSCHEMBL10147835C26H22ClF2N7O5585.95312 / 22.2No
5483222D structureCHEMBL3987084C26H22ClF2N7O5585.95312 / 22.2No
380182D structureCHEMBL404280C25H23Cl2F3N4O5587.37710 / 25.0No
380572D structureCHEMBL204562C29H30F2N4O3520.5818 / 14.5No
383762D structureCHEMBL196494C24H23F3N4O2456.4697 / 34.2Yes
385882D structureCHEMBL208386C28H39N3O3S497.6985 / 23.9Yes
411682D structureCHEMBL218605C23H19F5N4O3494.42210 / 24.4Yes
422322D structureCHEMBL525092C30H34N4O5S562.6857 / 32.9No
5586052D structureSCHEMBL10147810C25H21ClF2N6O5558.92711 / 22.8No
5483832D structureCHEMBL3910554C25H21ClF2N6O5558.92711 / 22.8No
439272D structureCHEMBL604999C24H18ClF2N7O4541.911 / 34.7No
442312D structureCipargaminC19H14Cl2FN3O390.2393 / 33.9Yes
447002D structureCHEMBL1939764C24H27N3O5S469.5566 / 22.1Yes
447322D structureCHEMBL496341C26H37N3O5S503.6587 / 22.7No
450912D structureCHEMBL298158C35H42N6O2578.7615 / 26.5No
458172D structureCHEMBL360500C22H21N5O3403.4426 / 23.2Yes

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