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Compile Data Set for Download or QSAR

Found 37 hits Enz. Inhib. hit(s) with Target = 'Ryanodine receptor 1' AND taxid = 9986   
Target
(Institution)
LigandTarget
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50044989
PNG
((O10eq)-beta-guanidinopropionylryanodine | CHEMBL2...)
Show SMILES CC(C)C1(O)[C@@H](OC(=O)c2ccc[nH]2)C2(O)[C@@]3(C)CC4(O)OC5([C@H](OC(=O)CCNC(N)=N)C(C)CCC35O)C2(O)C14C
Show InChI InChI=1S/C29H42N4O10/c1-14(2)26(38)20(42-19(35)16-7-6-11-32-16)27(39)22(4)13-25(37)23(26,5)29(27,40)28(43-25)18(15(3)8-10-24(22,28)36)41-17(34)9-12-33-21(30)31/h6-7,11,14-15,18,20,32,36-40H,8-10,12-13H2,1-5H3,(H4,30,31,33)/t15?,18-,20-,22+,23?,24?,25?,26?,27?,28?,29?/m1/s1
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n/an/a 1.10n/an/an/an/an/an/a



Indiana University

Curated by ChEMBL


Assay Description
Affinity for sarcoplasmic reticular calcium release channel (SR CRC) of rabbit skeletal membrane vesicles


J Med Chem 36: 1319-23 (1993)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50044982
PNG
(CHEMBL283836 | GLYCYLRYANODINE)
Show SMILES CC(C)C1(O)[C@@H](OC(=O)c2ccc[nH]2)C2(O)[C@@]3(C)CC4(O)OC5([C@H](OC(=O)CN)C(C)CCC35O)C2(O)C14C
Show InChI InChI=1S/C27H38N2O10/c1-13(2)24(34)19(38-18(31)15-7-6-10-29-15)25(35)20(4)12-23(33)21(24,5)27(25,36)26(39-23)17(37-16(30)11-28)14(3)8-9-22(20,26)32/h6-7,10,13-14,17,19,29,32-36H,8-9,11-12,28H2,1-5H3/t14?,17-,19-,20+,21?,22?,23?,24?,25?,26?,27?/m1/s1
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n/an/a 1.80n/an/an/an/an/an/a



Indiana University

Curated by ChEMBL


Assay Description
Affinity for sarcoplasmic reticular calcium release channel (SR CRC) of rabbit skeletal membrane vesicles


J Med Chem 36: 1319-23 (1993)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50044986
PNG
((O10eq)-guanidino acetylryanodine | CHEMBL435362)
Show SMILES CC(C)C1(O)[C@@H](OC(=O)c2ccc[nH]2)C2(O)[C@@]3(C)CC4(O)OC5([C@H](OC(=O)CNC(N)=N)C(C)CCC35O)C2(O)C14C
Show InChI InChI=1S/C28H40N4O10/c1-13(2)25(37)19(41-18(34)15-7-6-10-31-15)26(38)21(4)12-24(36)22(25,5)28(26,39)27(42-24)17(14(3)8-9-23(21,27)35)40-16(33)11-32-20(29)30/h6-7,10,13-14,17,19,31,35-39H,8-9,11-12H2,1-5H3,(H4,29,30,32)/t14?,17-,19-,21+,22?,23?,24?,25?,26?,27?,28?/m1/s1
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Indiana University

Curated by ChEMBL


Assay Description
Affinity for sarcoplasmic reticular calcium release channel (SR CRC) of rabbit skeletal membrane vesicles


J Med Chem 36: 1319-23 (1993)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50044995
PNG
((O10eq)-beta-alanylryanodine | CHEMBL282089)
Show SMILES CC(C)C1(O)[C@@H](OC(=O)c2ccc[nH]2)C2(O)[C@@]3(C)CC4(O)OC5([C@H](OC(=O)CCN)C(C)CCC35O)C2(O)C14C
Show InChI InChI=1S/C28H40N2O10/c1-14(2)25(35)20(39-19(32)16-7-6-12-30-16)26(36)21(4)13-24(34)22(25,5)28(26,37)27(40-24)18(38-17(31)9-11-29)15(3)8-10-23(21,27)33/h6-7,12,14-15,18,20,30,33-37H,8-11,13,29H2,1-5H3/t15?,18-,20-,21+,22?,23?,24?,25?,26?,27?,28?/m1/s1
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n/an/a 2.60n/an/an/an/an/an/a



Indiana University

Curated by ChEMBL


Assay Description
Affinity for sarcoplasmic reticular calcium release channel (SR CRC) of rabbit skeletal membrane vesicles


J Med Chem 36: 1319-23 (1993)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50044993
PNG
(Benzyloxycarbonyl-glycylryanodine | CHEMBL28383)
Show SMILES CC(C)C1(O)[C@@H](OC(=O)c2ccc[nH]2)C2(O)[C@@]3(C)CC4(O)OC5([C@H](OC(=O)CNC(=O)OCc6ccccc6)C(C)CCC35O)C2(O)C14C
Show InChI InChI=1S/C35H44N2O12/c1-19(2)32(43)26(48-25(39)22-12-9-15-36-22)33(44)28(4)18-31(42)29(32,5)35(33,45)34(49-31)24(20(3)13-14-30(28,34)41)47-23(38)16-37-27(40)46-17-21-10-7-6-8-11-21/h6-12,15,19-20,24,26,36,41-45H,13-14,16-18H2,1-5H3,(H,37,40)/t20?,24-,26-,28+,29?,30?,31?,32?,33?,34?,35?/m1/s1
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n/an/a 4.80n/an/an/an/an/an/a



Indiana University

Curated by ChEMBL


Assay Description
Affinity for sarcoplasmic reticular calcium release channel (SR CRC) of rabbit skeletal membrane vesicles


J Med Chem 36: 1319-23 (1993)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50044990
PNG
((O10eq)-Benzyloxycarbonyl-beta-alanylryanodine | C...)
Show SMILES CC(C)C1(O)[C@@H](OC(=O)c2ccc[nH]2)C2(O)[C@@]3(C)CC4(O)OC5([C@H](OC(=O)CCNC(=O)OCc6ccccc6)C(C)CCC35O)C2(O)C14C
Show InChI InChI=1S/C36H46N2O12/c1-20(2)33(44)27(49-26(40)23-12-9-16-37-23)34(45)29(4)19-32(43)30(33,5)36(34,46)35(50-32)25(21(3)13-15-31(29,35)42)48-24(39)14-17-38-28(41)47-18-22-10-7-6-8-11-22/h6-12,16,20-21,25,27,37,42-46H,13-15,17-19H2,1-5H3,(H,38,41)/t21?,25-,27-,29+,30?,31?,32?,33?,34?,35?,36?/m1/s1
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n/an/a 5.90n/an/an/an/an/an/a



Indiana University

Curated by ChEMBL


Assay Description
Affinity for sarcoplasmic reticular calcium release channel (SR CRC) of rabbit skeletal membrane vesicles


J Med Chem 36: 1319-23 (1993)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50044994
PNG
(2,6,9,11,13,14-hexahydroxy-11-isopropyl-3,7,10-tri...)
Show SMILES CC(C)[C@@]1(O)[C@@H](OC(=O)c2cc[nH]c2)[C@@]2(O)[C@]3(C)C[C@@]4(O)O[C@@]5([C@H](O)[C@@H](C)CC[C@]35O)[C@@]2(O)[C@]14C
Show InChI InChI=1S/C25H35NO9/c1-12(2)22(31)17(34-16(28)14-7-9-26-10-14)23(32)18(4)11-21(30)19(22,5)25(23,33)24(35-21)15(27)13(3)6-8-20(18,24)29/h7,9-10,12-13,15,17,26-27,29-33H,6,8,11H2,1-5H3/t13-,15+,17+,18+,19-,20-,21+,22+,23+,24+,25+/m0/s1
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n/an/a 6.20n/an/an/an/an/an/a



Indiana University

Curated by ChEMBL


Assay Description
Affinity for sarcoplasmic reticular calcium release channel (SR CRC) of rabbit skeletal membrane vesicles


J Med Chem 36: 1319-23 (1993)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50044991
PNG
(2,6,9,11,13,14-hexahydroxy-11-isopropyl-7,10-dimet...)
Show SMILES CC(C)C1(O)[C@@H](OC(=O)c2ccc[nH]2)C2(O)[C@@]3(C)CC4(O)OC5([C@H](O)C(=C)CCC35O)C2(O)C14C
Show InChI InChI=1S/C25H33NO9/c1-12(2)22(31)17(34-16(28)14-7-6-10-26-14)23(32)18(4)11-21(30)19(22,5)25(23,33)24(35-21)15(27)13(3)8-9-20(18,24)29/h6-7,10,12,15,17,26-27,29-33H,3,8-9,11H2,1-2,4-5H3/t15-,17-,18+,19?,20?,21?,22?,23?,24?,25?/m1/s1
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n/an/a 8.90n/an/an/an/an/an/a



Indiana University

Curated by ChEMBL


Assay Description
Affinity for sarcoplasmic reticular calcium release channel (SR CRC) of rabbit skeletal membrane vesicles


J Med Chem 36: 1319-23 (1993)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50044994
PNG
(2,6,9,11,13,14-hexahydroxy-11-isopropyl-3,7,10-tri...)
Show SMILES CC(C)[C@@]1(O)[C@@H](OC(=O)c2cc[nH]c2)[C@@]2(O)[C@]3(C)C[C@@]4(O)O[C@@]5([C@H](O)[C@@H](C)CC[C@]35O)[C@@]2(O)[C@]14C
Show InChI InChI=1S/C25H35NO9/c1-12(2)22(31)17(34-16(28)14-7-9-26-10-14)23(32)18(4)11-21(30)19(22,5)25(23,33)24(35-21)15(27)13(3)6-8-20(18,24)29/h7,9-10,12-13,15,17,26-27,29-33H,6,8,11H2,1-5H3/t13-,15+,17+,18+,19-,20-,21+,22+,23+,24+,25+/m0/s1
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n/an/a 10n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]ryanodine from Ca2+-ryanodine receptor in Oryctolagus cuniculus (rabbit) skeletal muscle sarcoplasmic reticulum after 80 min by c...


J Med Chem 30: 710-6 (1987)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50016403
PNG
(2,6,9,11,13,14-hexahydroxy-11-isopropyl-7,10-dimet...)
Show SMILES CC(C)[C@@]1(O)[C@@H](OC(=O)c2ccc[nH]2)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@H](O)C(=C)CC[C@]35O)[C@@]2(O)[C@]14C
Show InChI InChI=1S/C25H33NO9/c1-12(2)22(31)17(34-16(28)14-7-6-10-26-14)23(32)18(4)11-21(30)19(22,5)25(23,33)24(35-21)15(27)13(3)8-9-20(18,24)29/h6-7,10,12,15,17,26-27,29-33H,3,8-9,11H2,1-2,4-5H3/t15-,17-,18+,19-,20+,21+,22-,23-,24-,25-/m1/s1
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n/an/a 13n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]ryanodine from Ca2+-ryanodine receptor in Oryctolagus cuniculus (rabbit) skeletal muscle sarcoplasmic reticulum after 80 min by c...


J Med Chem 30: 710-6 (1987)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50016410
PNG
(2,6,9,11,13,14-hexahydroxy-11-(2-hydroxy-1-methyle...)
Show SMILES CC(C)[C@@]1(O)[C@@H](OC(=O)c2ccc[nH]2)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@H](O)[C@H](C)CC[C@]35O)[C@@]2(O)[C@]14C
Show InChI InChI=1S/C25H35NO10/c1-12-7-8-20(30)18(3)11-21(31)19(4)22(32,13(2)10-27)17(35-16(29)14-6-5-9-26-14)23(18,33)25(19,34)24(20,36-21)15(12)28/h5-6,9,12-13,15,17,26-28,30-34H,7-8,10-11H2,1-4H3/t12-,13?,15+,17+,18-,19+,20-,21-,22+,23+,24+,25+/m0/s1
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n/an/a 41n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]ryanodine from Ca2+-ryanodine receptor in Oryctolagus cuniculus (rabbit) skeletal muscle sarcoplasmic reticulum after 80 min by c...


J Med Chem 30: 710-6 (1987)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50044987
PNG
((O10eq)-beta-N,N'-Bis-Benzyloxycarbonyl-guanidinop...)
Show SMILES CC(C)C1(O)[C@@H](OC(=O)c2ccc[nH]2)C2(O)[C@@]3(C)CC4(O)OC5([C@H](OC(=O)CCNC(NC(=O)OCc6ccccc6)=NC(=O)OCc6ccccc6)C(C)CCC35O)C2(O)C14C
Show InChI InChI=1S/C45H54N4O14/c1-26(2)42(56)34(62-33(51)30-17-12-21-46-30)43(57)38(4)25-41(55)39(42,5)45(43,58)44(63-41)32(27(3)18-20-40(38,44)54)61-31(50)19-22-47-35(48-36(52)59-23-28-13-8-6-9-14-28)49-37(53)60-24-29-15-10-7-11-16-29/h6-17,21,26-27,32,34,46,54-58H,18-20,22-25H2,1-5H3,(H2,47,48,49,52,53)/t27?,32-,34-,38+,39?,40?,41?,42?,43?,44?,45?/m1/s1
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n/an/a 44n/an/an/an/an/an/a



Indiana University

Curated by ChEMBL


Assay Description
Affinity for sarcoplasmic reticular calcium release channel (SR CRC) of rabbit skeletal membrane vesicles


J Med Chem 36: 1319-23 (1993)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50044988
PNG
(CHEMBL432278 | N-methyl ryanodine-succinamidate)
Show SMILES CNC(=O)CCC(=O)O[C@@H]1C(C)CCC2(O)[C@]3(C)CC4(O)OC12C1(O)C3(O)[C@H](OC(=O)c2ccc[nH]2)C(O)(C(C)C)C41C
Show InChI InChI=1S/C30H42N2O11/c1-15(2)27(38)22(42-21(35)17-8-7-13-32-17)28(39)23(4)14-26(37)24(27,5)30(28,40)29(43-26)20(16(3)11-12-25(23,29)36)41-19(34)10-9-18(33)31-6/h7-8,13,15-16,20,22,32,36-40H,9-12,14H2,1-6H3,(H,31,33)/t16?,20-,22-,23+,24?,25?,26?,27?,28?,29?,30?/m1/s1
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n/an/a 49n/an/an/an/an/an/a



Indiana University

Curated by ChEMBL


Assay Description
Affinity for sarcoplasmic reticular calcium release channel (SR CRC) of rabbit skeletal membrane vesicles


J Med Chem 36: 1319-23 (1993)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50016413
PNG
(18-HYDROXYRYANODINE | 2,6,9,11,13,14-hexahydroxy-1...)
Show SMILES CC(CO)[C@@]1(O)[C@@H](OC(=O)c2ccc[nH]2)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@H](O)[C@@H](C)CC[C@]35O)[C@@]2(O)[C@]14C
Show InChI InChI=1S/C25H35NO9/c1-12(2)22(31)17(34-16(28)14-7-6-10-26-14)23(32)18(4)11-21(30)19(22,5)25(23,33)24(35-21)15(27)13(3)8-9-20(18,24)29/h6-7,10,12-13,15,17,26-27,29-33H,8-9,11H2,1-5H3/t13-,15-,17-,18+,19-,20+,21+,22-,23-,24-,25-/m1/s1
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n/an/a 88n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]ryanodine from Ca2+-ryanodine receptor in Oryctolagus cuniculus (rabbit) skeletal muscle sarcoplasmic reticulum after 80 min by c...


J Med Chem 30: 710-6 (1987)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50016418
PNG
(10-KETORYANODINE | 6,9,11,13,14-pentahydroxy-11-is...)
Show SMILES CC(C)[C@@]1(O)[C@@H](OC(=O)c2ccc[nH]2)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5(C(=O)[C@@H](C)CC[C@]35O)[C@@]2(O)[C@]14C
Show InChI InChI=1S/C25H33NO9/c1-12(2)22(31)17(34-16(28)14-7-6-10-26-14)23(32)18(4)11-21(30)19(22,5)25(23,33)24(35-21)15(27)13(3)8-9-20(18,24)29/h6-7,10,12-13,17,26,29-33H,8-9,11H2,1-5H3/t13-,17+,18-,19+,20-,21-,22+,23+,24+,25+/m0/s1
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n/an/a 100n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]ryanodine from Ca2+-ryanodine receptor in Oryctolagus cuniculus (rabbit) skeletal muscle sarcoplasmic reticulum after 80 min by c...


J Med Chem 30: 710-6 (1987)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50044984
PNG
(CHEMBL416926 | Di-Benzyloxycarbonyl-guanidino acet...)
Show SMILES CC(C)C1(O)[C@@H](OC(=O)c2ccc[nH]2)C2(O)[C@@]3(C)CC4(O)OC5([C@H](OC(=O)CNC(NC(=O)OCc6ccccc6)=NC(=O)OCc6ccccc6)C(C)CCC35O)C2(O)C14C
Show InChI InChI=1S/C44H52N4O14/c1-25(2)41(55)33(61-32(50)29-17-12-20-45-29)42(56)37(4)24-40(54)38(41,5)44(42,57)43(62-40)31(26(3)18-19-39(37,43)53)60-30(49)21-46-34(47-35(51)58-22-27-13-8-6-9-14-27)48-36(52)59-23-28-15-10-7-11-16-28/h6-17,20,25-26,31,33,45,53-57H,18-19,21-24H2,1-5H3,(H2,46,47,48,51,52)/t26?,31-,33-,37+,38?,39?,40?,41?,42?,43?,44?/m1/s1
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n/an/a 136n/an/an/an/an/an/a



Indiana University

Curated by ChEMBL


Assay Description
Affinity for sarcoplasmic reticular calcium release channel (SR CRC) of rabbit skeletal membrane vesicles


J Med Chem 36: 1319-23 (1993)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50016416
PNG
(10-ACETYLRYANODINE | 6,9,11,13,14-pentahydroxy-11-...)
Show SMILES CC(C)[C@@]1(O)[C@@H](OC(=O)c2ccc[nH]2)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@H](OC(C)=O)[C@@H](C)CC[C@]35O)[C@@]2(O)[C@]14C
Show InChI InChI=1S/C27H37NO10/c1-13(2)24(33)19(37-18(30)16-8-7-11-28-16)25(34)20(5)12-23(32)21(24,6)27(25,35)26(38-23)17(36-15(4)29)14(3)9-10-22(20,26)31/h7-8,11,13-14,17,19,28,31-35H,9-10,12H2,1-6H3/t14-,17+,19+,20-,21+,22-,23-,24+,25+,26+,27+/m0/s1
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n/an/a 140n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]ryanodine from Ca2+-ryanodine receptor in Oryctolagus cuniculus (rabbit) skeletal muscle sarcoplasmic reticulum after 80 min by c...


J Med Chem 30: 710-6 (1987)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50016411
PNG
(2',6',9',11',13',14'-hexahydroxy-11'-isopropyl-7',...)
Show SMILES CC(C)[C@@]1(O)[C@@H](OC(=O)c2ccc[nH]2)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@H](O)C6(CO6)CC[C@]35O)[C@@]2(O)[C@]14C
Show InChI InChI=1S/C25H33NO10/c1-12(2)22(31)16(35-14(27)13-6-5-9-26-13)23(32)17(3)10-21(30)18(22,4)25(23,33)24(36-21)15(28)19(11-34-19)7-8-20(17,24)29/h5-6,9,12,15-16,26,28-33H,7-8,10-11H2,1-4H3/t15-,16-,17+,18-,19?,20+,21+,22-,23-,24-,25-/m1/s1
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n/an/a 140n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]ryanodine from Ca2+-ryanodine receptor in Oryctolagus cuniculus (rabbit) skeletal muscle sarcoplasmic reticulum after 80 min by c...


J Med Chem 30: 710-6 (1987)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50044992
PNG
((O10eq)-beta-alanyl-anhydro-ryanodine | CHEMBL2826...)
Show SMILES CC(C)C1=C(C)C2(O)C(O)([C@@H]1OC(=O)c1ccc[nH]1)[C@@]1(C)CC(=O)OC22[C@H](OC(=O)CCN)C(C)CCC12O
Show InChI InChI=1S/C28H38N2O9/c1-14(2)20-16(4)26(35)27(36,22(20)38-23(33)17-7-6-12-30-17)24(5)13-19(32)39-28(26)21(37-18(31)9-11-29)15(3)8-10-25(24,28)34/h6-7,12,14-15,21-22,30,34-36H,8-11,13,29H2,1-5H3/t15?,21-,22-,24+,25?,26?,27?,28?/m1/s1
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n/an/a 149n/an/an/an/an/an/a



Indiana University

Curated by ChEMBL


Assay Description
Affinity for sarcoplasmic reticular calcium release channel (SR CRC) of rabbit skeletal membrane vesicles


J Med Chem 36: 1319-23 (1993)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50016406
PNG
(2,6,11,13,14-pentahydroxy-11-isopropyl-9-methoxy-3...)
Show SMILES CO[C@@]12C[C@@]3(C)[C@@]4(O)CC[C@H](C)[C@@H](O)[C@]4(O1)[C@]1(O)[C@@]3(O)[C@H](OC(=O)c3cccn3C)[C@](O)(C(C)C)[C@]21C
Show InChI InChI=1S/C27H39NO9/c1-14(2)24(32)19(36-18(30)16-9-8-12-28(16)6)25(33)20(4)13-23(35-7)21(24,5)27(25,34)26(37-23)17(29)15(3)10-11-22(20,26)31/h8-9,12,14-15,17,19,29,31-34H,10-11,13H2,1-7H3/t15-,17+,19+,20-,21+,22-,23-,24+,25+,26+,27+/m0/s1
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n/an/a 280n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]ryanodine from Ca2+-ryanodine receptor in Oryctolagus cuniculus (rabbit) skeletal muscle sarcoplasmic reticulum after 80 min by c...


J Med Chem 30: 710-6 (1987)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50016417
PNG
(2,6,9,11,13,14-hexahydroxy-11-isopropyl-3,7,10-tri...)
Show SMILES CC(C)[C@@]1(O)[C@@H](OC(=O)c2cccn2Cc2ccccc2)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@H](O)[C@@H](C)CC[C@]35O)[C@@]2(O)[C@]14C
Show InChI InChI=1S/C32H41NO9/c1-18(2)29(38)24(41-23(35)21-12-9-15-33(21)16-20-10-7-6-8-11-20)30(39)25(4)17-28(37)26(29,5)32(30,40)31(42-28)22(34)19(3)13-14-27(25,31)36/h6-12,15,18-19,22,24,34,36-40H,13-14,16-17H2,1-5H3/t19-,22+,24+,25-,26+,27-,28-,29+,30+,31+,32+/m0/s1
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n/an/a 310n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]ryanodine from Ca2+-ryanodine receptor in Oryctolagus cuniculus (rabbit) skeletal muscle sarcoplasmic reticulum after 80 min by c...


J Med Chem 30: 710-6 (1987)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50016405
PNG
(2,6,9,11,13,14-hexahydroxy-11-isopropyl-3,7,10-tri...)
Show SMILES CCCCn1cccc1C(=O)O[C@@H]1[C@](O)(C(C)C)[C@]2(C)[C@]3(O)C[C@@]4(C)[C@@]5(O)CC[C@H](C)[C@@H](O)[C@]5(O3)[C@]2(O)[C@@]14O
Show InChI InChI=1S/C29H43NO9/c1-7-8-13-30-14-9-10-18(30)20(32)38-21-26(35,16(2)3)23(6)25(34)15-22(5)24(33)12-11-17(4)19(31)28(24,39-25)29(23,37)27(21,22)36/h9-10,14,16-17,19,21,31,33-37H,7-8,11-13,15H2,1-6H3/t17-,19+,21+,22-,23+,24-,25-,26+,27+,28+,29+/m0/s1
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n/an/a 860n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]ryanodine from Ca2+-ryanodine receptor in Oryctolagus cuniculus (rabbit) skeletal muscle sarcoplasmic reticulum after 80 min by c...


J Med Chem 30: 710-6 (1987)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50044985
PNG
(ryanodine-hemi-succinate)
Show SMILES CC(C)C1(O)[C@@H](OC(=O)c2ccc[nH]2)C2(O)[C@@]3(C)CC4(O)OC5([C@H](OC(=O)CCC([O-])=O)C(C)CCC35O)C2(O)C14C
Show InChI InChI=1S/C29H39NO12/c1-14(2)26(37)21(41-20(34)16-7-6-12-30-16)27(38)22(4)13-25(36)23(26,5)29(27,39)28(42-25)19(15(3)10-11-24(22,28)35)40-18(33)9-8-17(31)32/h6-7,12,14-15,19,21,30,35-39H,8-11,13H2,1-5H3,(H,31,32)/p-1/t15?,19-,21-,22+,23?,24?,25?,26?,27?,28?,29?/m1/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a



Indiana University

Curated by ChEMBL


Assay Description
Affinity for sarcoplasmic reticular calcium release channel (SR CRC) of rabbit skeletal membrane vesicles


J Med Chem 36: 1319-23 (1993)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50016412
PNG
(2,11,13,14-tetrahydroxy-11-isopropyl-6,9-dimethoxy...)
Show SMILES CO[C@@]12C[C@@]3(C)[C@]4(CC[C@H](C)[C@@H](O)[C@]4(O1)[C@]1(O)[C@@]3(O)[C@H](OC(=O)c3cccn3C)[C@](O)(C(C)C)[C@]21C)OC
Show InChI InChI=1S/C28H41NO9/c1-15(2)25(32)20(37-19(31)17-10-9-13-29(17)6)26(33)21(4)14-24(36-8)22(25,5)28(26,34)27(38-24)18(30)16(3)11-12-23(21,27)35-7/h9-10,13,15-16,18,20,30,32-34H,11-12,14H2,1-8H3/t16-,18+,20+,21-,22+,23-,24-,25+,26+,27+,28+/m0/s1
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n/an/a 1.30E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]ryanodine from Ca2+-ryanodine receptor in Oryctolagus cuniculus (rabbit) skeletal muscle sarcoplasmic reticulum after 80 min by c...


J Med Chem 30: 710-6 (1987)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50016409
PNG
(2,6,11,14-tetrahydroxy-11-isopropyl-9,13-dimethoxy...)
Show SMILES CO[C@@]12C[C@@]3(C)[C@@]4(O)CC[C@H](C)[C@@H](O)[C@]4(O1)[C@@]1(O)[C@]2(C)[C@@](O)(C(C)C)[C@@H](OC(=O)c2cccn2C)[C@@]31OC
Show InChI InChI=1S/C28H41NO9/c1-15(2)25(33)20(37-19(31)17-10-9-13-29(17)6)27(36-8)21(4)14-24(35-7)22(25,5)28(27,34)26(38-24)18(30)16(3)11-12-23(21,26)32/h9-10,13,15-16,18,20,30,32-34H,11-12,14H2,1-8H3/t16-,18+,20+,21-,22+,23-,24-,25+,26+,27+,28-/m0/s1
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n/an/a 4.50E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]ryanodine from Ca2+-ryanodine receptor in Oryctolagus cuniculus (rabbit) skeletal muscle sarcoplasmic reticulum after 80 min by c...


J Med Chem 30: 710-6 (1987)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50016404
PNG
(2,3,6,9,11,13,14-heptahydroxy-3-hydroxymethyl-11-i...)
Show SMILES CC(C)[C@@]1(O)[C@@H](OC(=O)c2ccc[nH]2)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@H](O)[C@](O)(CO)CC[C@]35O)[C@@]2(O)[C@]14C
Show InChI InChI=1S/C25H35NO11/c1-12(2)22(33)16(36-14(28)13-6-5-9-26-13)23(34)17(3)10-21(32)18(22,4)25(23,35)24(37-21)15(29)19(30,11-27)7-8-20(17,24)31/h5-6,9,12,15-16,26-27,29-35H,7-8,10-11H2,1-4H3/t15-,16-,17+,18-,19-,20+,21+,22-,23-,24-,25-/m1/s1
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n/an/a 4.90E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]ryanodine from Ca2+-ryanodine receptor in Oryctolagus cuniculus (rabbit) skeletal muscle sarcoplasmic reticulum after 80 min by c...


J Med Chem 30: 710-6 (1987)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50016414
PNG
(6,9,11,13,14-pentahydroxy-11-isopropyl-3,7,10-trim...)
Show SMILES CC(C)[C@@]1(O)[C@@H](OC(=O)c2ccc[nH]2)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5(C(=O)C(C)=CC[C@]35O)[C@@]2(O)[C@]14C
Show InChI InChI=1S/C25H31NO9/c1-12(2)22(31)17(34-16(28)14-7-6-10-26-14)23(32)18(4)11-21(30)19(22,5)25(23,33)24(35-21)15(27)13(3)8-9-20(18,24)29/h6-8,10,12,17,26,29-33H,9,11H2,1-5H3/t17-,18+,19-,20+,21+,22-,23-,24-,25-/m1/s1
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n/an/a 7.30E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]ryanodine from Ca2+-ryanodine receptor in Oryctolagus cuniculus (rabbit) skeletal muscle sarcoplasmic reticulum after 80 min by c...


J Med Chem 30: 710-6 (1987)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50016420
PNG
(2,6,9,11,13,14-hexahydroxy-11-isopropyl-3,7,10-tri...)
Show SMILES CC(C)[C@@]1(O)[C@@H](OC(=O)c2[nH]c(Br)c(Br)c2Br)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@H](O)[C@@H](C)CC[C@]35O)[C@@]2(O)[C@]14C
Show InChI InChI=1S/C25H32Br3NO9/c1-9(2)22(34)17(37-16(31)13-11(26)12(27)15(28)29-13)23(35)18(4)8-21(33)19(22,5)25(23,36)24(38-21)14(30)10(3)6-7-20(18,24)32/h9-10,14,17,29-30,32-36H,6-8H2,1-5H3/t10-,14+,17+,18-,19+,20-,21-,22+,23+,24+,25+/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]ryanodine from Ca2+-ryanodine receptor in Oryctolagus cuniculus (rabbit) skeletal muscle sarcoplasmic reticulum after 80 min by c...


J Med Chem 30: 710-6 (1987)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50016407
PNG
(6,11,14-trihydroxy-11-isopropyl-2,9,13-trimethoxy-...)
Show SMILES CO[C@@H]1[C@@H](C)CC[C@]2(O)[C@]3(C)C[C@]4(OC)O[C@]12[C@@]1(O)[C@]4(C)[C@@](O)(C(C)C)[C@@H](OC(=O)c2cccn2C)[C@@]31OC
Show InChI InChI=1S/C29H43NO9/c1-16(2)26(33)21(38-20(31)18-11-10-14-30(18)6)28(37-9)22(4)15-25(36-8)23(26,5)29(28,34)27(39-25)19(35-7)17(3)12-13-24(22,27)32/h10-11,14,16-17,19,21,32-34H,12-13,15H2,1-9H3/t17-,19+,21+,22-,23+,24-,25-,26+,27+,28+,29-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]ryanodine from Ca2+-ryanodine receptor in Oryctolagus cuniculus (rabbit) skeletal muscle sarcoplasmic reticulum after 80 min by c...


J Med Chem 30: 710-6 (1987)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50016402
PNG
(11-isopropyl-7,10-dimethyl-3-methylene-(1R,2R,6S,7...)
Show SMILES CC(C)[C@@]1(O)[C@@H](O)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@H](O)C(=C)CC[C@]35O)[C@@]2(O)[C@]14C
Show InChI InChI=1S/C20H30O8/c1-9(2)17(25)12(22)18(26)13(4)8-16(24)14(17,5)20(18,27)19(28-16)11(21)10(3)6-7-15(13,19)23/h9,11-12,21-27H,3,6-8H2,1-2,4-5H3/t11-,12-,13+,14-,15+,16+,17-,18-,19-,20-/m1/s1
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n/an/a 1.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]ryanodine from Ca2+-ryanodine receptor in Oryctolagus cuniculus (rabbit) skeletal muscle sarcoplasmic reticulum after 80 min by c...


J Med Chem 30: 710-6 (1987)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50016408
PNG
(2,6,8,12-tetrahydroxy-10-isopropyl-3,7,11-trimethy...)
Show SMILES CC(C)C1=C(C)[C@@]2(O)[C@@](O)([C@@H]1OC(=O)c1ccc[nH]1)[C@@]1(C)CC(=O)O[C@@]22[C@H](O)[C@@H](C)CC[C@]12O
Show InChI InChI=1S/C25H33NO8/c1-12(2)17-14(4)23(31)24(32,19(17)33-20(29)15-7-6-10-26-15)21(5)11-16(27)34-25(23)18(28)13(3)8-9-22(21,25)30/h6-7,10,12-13,18-19,26,28,30-32H,8-9,11H2,1-5H3/t13-,18+,19+,21-,22-,23+,24+,25+/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]ryanodine from Ca2+-ryanodine receptor in Oryctolagus cuniculus (rabbit) skeletal muscle sarcoplasmic reticulum after 80 min by c...


J Med Chem 30: 710-6 (1987)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50016415
PNG
(11-isopropyl-3,7,10-trimethyl-(1R,2R,3S,6S,7S,9S,1...)
Show SMILES CC(C)[C@@]1(O)[C@@H](O)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@H](O)[C@@H](C)CC[C@]35O)[C@@]2(O)[C@]14C
Show InChI InChI=1S/C20H32O8/c1-9(2)17(25)12(22)18(26)13(4)8-16(24)14(17,5)20(18,27)19(28-16)11(21)10(3)6-7-15(13,19)23/h9-12,21-27H,6-8H2,1-5H3/t10-,11+,12+,13-,14+,15-,16-,17+,18+,19+,20+/m0/s1
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n/an/a 3.50E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]ryanodine from Ca2+-ryanodine receptor in Oryctolagus cuniculus (rabbit) skeletal muscle sarcoplasmic reticulum after 80 min by c...


J Med Chem 30: 710-6 (1987)

More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50241985
PNG
((E,Z)bastadin-19 | Bastadin-19 | CHEMBL506286 | CH...)
Show SMILES Oc1c(Br)cc2CCNC(=O)C(Cc3cc(Br)c(O)c(Oc4c(Br)cc(CC(N=O)C(=O)NCCc5ccc(Oc1c2)c(Br)c5)cc4Br)c3)N=O
Show InChI InChI=1S/C34H27Br5N4O8/c35-20-7-16-1-2-27(20)50-28-14-17(8-21(36)30(28)44)4-6-41-34(47)26(43-49)13-19-9-22(37)31(45)29(15-19)51-32-23(38)10-18(11-24(32)39)12-25(42-48)33(46)40-5-3-16/h1-2,7-11,14-15,25-26,44-45H,3-6,12-13H2,(H,40,46)(H,41,47)
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n/an/an/an/a>1.00E+5n/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Displacement of [3H]ryanodine from Ry1R/FKBP12 receptor complex in rabbit sarcoplasmic reticulum


Citation and Details
More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50191286
PNG
(Bastadin-5 | CHEMBL439151 | bastadin 5)
Show SMILES Oc1c(Br)cc2CCNC(=O)C(Cc3cc(Br)c(Oc4cc(CC(N=O)C(=O)NCCc5ccc(Oc1c2)c(Br)c5)cc(Br)c4O)c(Br)c3)N=O
Show InChI InChI=1S/C34H27Br5N4O8/c35-20-7-16-1-2-27(20)50-28-14-17(8-21(36)30(28)44)4-6-41-33(46)25(42-48)12-18-10-23(38)32(24(39)11-18)51-29-15-19(9-22(37)31(29)45)13-26(43-49)34(47)40-5-3-16/h1-2,7-11,14-15,25-26,44-45H,3-6,12-13H2,(H,40,47)(H,41,46)
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n/an/an/an/a 2.00E+3n/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Displacement of [3H]ryanodine from Ry1R/FKBP12 receptor complex in rabbit sarcoplasmic reticulum


Citation and Details
More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50292366
PNG
(10-sulfatobastadin 3 | CHEMBL450681)
Show SMILES Oc1ccc(CCNC(=O)C(Cc2cc(Br)c(O)c(c2)-c2cc(CC(N=O)C(=O)NCCc3ccc(OS([O-])(=O)=O)c(Br)c3)cc(Br)c2O)N=O)cc1Br
Show InChI InChI=1S/C34H30Br4N4O11S/c35-23-11-17(1-3-29(23)43)5-7-39-33(46)27(41-48)15-19-9-21(31(44)25(37)13-19)22-10-20(14-26(38)32(22)45)16-28(42-49)34(47)40-8-6-18-2-4-30(24(36)12-18)53-54(50,51)52/h1-4,9-14,27-28,43-45H,5-8,15-16H2,(H,39,46)(H,40,47)(H,50,51,52)/p-1
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n/an/an/an/a 1.00E+5n/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Displacement of [3H]ryanodine from Ry1R/FKBP12 receptor complex in rabbit sarcoplasmic reticulum


Citation and Details
More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50292368
PNG
(CHEMBL498932 | bastadin 20)
Show SMILES Oc1c(Br)cc2CCNC(=O)C(Cc3cc(Br)c(O)c(Oc4ccc(CC(N=O)C(=O)NCCc5ccc(Oc1c2)c(Br)c5)cc4Br)c3)N=O
Show InChI InChI=1S/C34H28Br4N4O8/c35-21-9-17-1-3-27(21)49-29-15-19(11-23(37)31(29)43)6-8-40-34(46)26(42-48)14-20-12-24(38)32(44)30(16-20)50-28-4-2-18(10-22(28)36)13-25(41-47)33(45)39-7-5-17/h1-4,9-12,15-16,25-26,43-44H,5-8,13-14H2,(H,39,45)(H,40,46)
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n/an/an/an/a 2.06E+4n/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Displacement of [3H]ryanodine from Ry1R/FKBP12 receptor complex in rabbit sarcoplasmic reticulum


Citation and Details
More data for this
Ligand-Target Pair
Ryanodine receptor 1


(Oryctolagus cuniculus)
BDBM50292367
PNG
(15,34-O-disulfatobastadin 7 | CHEMBL509326)
Show SMILES [O-]S(=O)(=O)Oc1c(Br)cc2CCNC(=O)C(Cc3ccc(Oc4cc(CC(N=O)C(=O)NC=Cc5ccc(Oc1c2)c(Br)c5)cc(Br)c4OS([O-])(=O)=O)c(Br)c3)N=O
Show InChI InChI=1S/C34H26Br4N4O14S2/c35-21-9-17-1-3-27(21)53-29-15-19(11-23(37)31(29)55-57(47,48)49)6-8-40-33(43)25(41-45)13-18-2-4-28(22(36)10-18)54-30-16-20(12-24(38)32(30)56-58(50,51)52)14-26(42-46)34(44)39-7-5-17/h1-5,7,9-12,15-16,25-26H,6,8,13-14H2,(H,39,44)(H,40,43)(H,47,48,49)(H,50,51,52)/p-2
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n/an/an/an/a 1.36E+4n/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Displacement of [3H]ryanodine from Ry1R/FKBP12 receptor complex in rabbit sarcoplasmic reticulum


Citation and Details
More data for this
Ligand-Target Pair