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Compile Data Set for Download or QSAR

Found 60 hits Enz. Inhib. hit(s) with Target = 'CAM-RNase A'   
Target/Host
(Institution)
LigandTarget/Host
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
CAM-RNase A


(Bison bison (American bison))
BDBM50391853
PNG
(CHEMBL2147156)
Show SMILES NCCNC(=O)CCN(CCNC(=O)CCN(CCNC(=O)CCN(CCN(CCC(=O)NCCN(CCC(=O)NCCN(CCC(=O)NCCN)CCC(=O)NCCN)CCC(=O)NCCN(CCC(=O)NCCN)CCC(=O)NCCN)CCC(=O)NCCN(CCC(=O)NCCN(CCC(=O)NCCN)CCC(=O)NCCN)CCC(=O)NCCN(CCC(=O)NCCN)CCC(=O)NCCN)CCC(=O)NCCN(CCC(=O)NCCN(CCC(=O)NCCN)CCC(=O)NCCN)CCC(=O)NCCN(CCC(=O)NCCN)CCC(=O)NCCN)CCC(=O)NCCN(CCC(=O)NCCN)CCC(=O)NCCN)CCC(=O)NCCN
Show InChI InChI=1S/C142H288N58O28/c143-29-45-159-115(201)1-73-187(74-2-116(202)160-46-30-144)101-61-175-131(217)17-89-195(90-18-132(218)176-62-102-188(75-3-117(203)161-47-31-145)76-4-118(204)162-48-32-146)109-69-183-139(225)25-97-199(98-26-140(226)184-70-110-196(91-19-133(219)177-63-103-189(77-5-119(205)163-49-33-147)78-6-120(206)164-50-34-148)92-20-134(220)178-64-104-190(79-7-121(207)165-51-35-149)80-8-122(208)166-52-36-150)113-114-200(99-27-141(227)185-71-111-197(93-21-135(221)179-65-105-191(81-9-123(209)167-53-37-151)82-10-124(210)168-54-38-152)94-22-136(222)180-66-106-192(83-11-125(211)169-55-39-153)84-12-126(212)170-56-40-154)100-28-142(228)186-72-112-198(95-23-137(223)181-67-107-193(85-13-127(213)171-57-41-155)86-14-128(214)172-58-42-156)96-24-138(224)182-68-108-194(87-15-129(215)173-59-43-157)88-16-130(216)174-60-44-158/h1-114,143-158H2,(H,159,201)(H,160,202)(H,161,203)(H,162,204)(H,163,205)(H,164,206)(H,165,207)(H,166,208)(H,167,209)(H,168,210)(H,169,211)(H,170,212)(H,171,213)(H,172,214)(H,173,215)(H,174,216)(H,175,217)(H,176,218)(H,177,219)(H,178,220)(H,179,221)(H,180,222)(H,181,223)(H,182,224)(H,183,225)(H,184,226)(H,185,227)(H,186,228)
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n/an/an/a 3.10E+3n/an/an/an/an/a



University of Wisconsin-Madison

Curated by ChEMBL


Assay Description
Inhibition of bovine RNase A interaction to ribonuclease inhibitor protein after 30 mins by competition assay


Bioorg Med Chem Lett 21: 2756-8 (2011)


Article DOI: 10.1016/j.bmcl.2010.11.028
BindingDB Entry DOI: 10.7270/Q2QC04K6
More data for this
Ligand-Target Pair
CAM-RNase A


(Bison bison (American bison))
BDBM50342010
PNG
(5'-phospho-2'-deoxyuridine-3'-pyrophosphate(P'->5'...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](OP(O)(=O)OC[C@H]2O[C@H](C[C@@H]2OP(O)(=O)OP(O)(O)=O)n2ccc(=O)[nH]c2=O)[C@H]1O
Show InChI InChI=1S/C19H26N7O17P3/c20-16-13-17(22-6-21-16)26(7-23-13)18-14(29)15(9(4-27)40-18)42-45(34,35)38-5-10-8(41-46(36,37)43-44(31,32)33)3-12(39-10)25-2-1-11(28)24-19(25)30/h1-2,6-10,12,14-15,18,27,29H,3-5H2,(H,34,35)(H,36,37)(H2,20,21,22)(H,24,28,30)(H2,31,32,33)/t8-,9+,10+,12+,14+,15+,18+/m0/s1
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27n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic RNase A at pH 5.9 by spectrophotometric method


Bioorg Med Chem 19: 2478-84 (2011)


Article DOI: 10.1016/j.bmc.2010.08.059
BindingDB Entry DOI: 10.7270/Q2736R7B
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
CAM-RNase A


(Bison bison (American bison))
BDBM50292721
PNG
(CHEMBL504858 | [({[(2R,3S,4R,5R)-5-(6-amino-9H-pur...)
Show SMILES Cc1cn([C@H]2C[C@H](OP(O)(=O)OP(O)(=O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3OP(O)(O)=O)n3cnc4c(N)ncnc34)[C@@H](COP(O)(O)=O)O2)c(=O)[nH]c1=O
Show InChI InChI=1S/C20H29N7O20P4/c1-8-3-26(20(30)25-18(8)29)12-2-9(10(43-12)4-41-48(31,32)33)45-51(39,40)47-50(37,38)42-5-11-15(46-49(34,35)36)14(28)19(44-11)27-7-24-13-16(21)22-6-23-17(13)27/h3,6-7,9-12,14-15,19,28H,2,4-5H2,1H3,(H,37,38)(H,39,40)(H2,21,22,23)(H,25,29,30)(H2,31,32,33)(H2,34,35,36)/t9-,10+,11+,12+,14+,15+,19+/m0/s1
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41n/an/an/an/an/an/an/an/a



Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic RNase A by spectrophotometric method


J Med Chem 52: 932-42 (2009)


Article DOI: 10.1021/jm800724t
BindingDB Entry DOI: 10.7270/Q2H99570
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
CAM-RNase A


(Bison bison (American bison))
BDBM50402337
PNG
(CHEMBL2206660)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cc(Cn2ccc(=O)[nH]c2=O)nn1
Show InChI InChI=1S/C12H15N5O6/c18-5-7-9(20)10(21)11(23-7)17-4-6(14-15-17)3-16-2-1-8(19)13-12(16)22/h1-2,4,7,9-11,18,20-21H,3,5H2,(H,13,19,22)/t7-,9-,10-,11-/m1/s1
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240n/an/an/an/an/an/an/an/a



University of Thessaly

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic RNase A


Bioorg Med Chem 20: 7184-93 (2012)


Article DOI: 10.1016/j.bmc.2012.09.067
BindingDB Entry DOI: 10.7270/Q2M61MDG
More data for this
Ligand-Target Pair
CAM-RNase A


(Bison bison (American bison))
BDBM50292724
PNG
(CHEMBL460901 | URACIL ARABINOSE-3'-PHOSPHATE | ara...)
Show SMILES OC[C@H]1O[C@H]([C@@H](O)[C@@H]1OP(O)(O)=O)n1ccc(=O)[nH]c1=O
Show InChI InChI=1S/C9H13N2O9P/c12-3-4-7(20-21(16,17)18)6(14)8(19-4)11-2-1-5(13)10-9(11)15/h1-2,4,6-8,12,14H,3H2,(H,10,13,15)(H2,16,17,18)/t4-,6+,7-,8-/m1/s1
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6.00E+3n/an/an/an/an/an/an/an/a



Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic RNase A by spectrophotometric method


J Med Chem 52: 932-42 (2009)


Article DOI: 10.1021/jm800724t
BindingDB Entry DOI: 10.7270/Q2H99570
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
CAM-RNase A


(Bison bison (American bison))
BDBM50298711
PNG
((2R,3R,4R,5R)-2-(4-amino-2-oxopyrimidin-1(2H)-yl)-...)
Show SMILES Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2OP(O)(O)=O)c(=O)n1
Show InChI InChI=1S/C9H14N3O8P/c10-5-1-2-12(9(15)11-5)8-7(20-21(16,17)18)6(14)4(3-13)19-8/h1-2,4,6-8,13-14H,3H2,(H2,10,11,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1
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7.00E+3n/an/an/an/an/an/an/an/a



Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic RNase A by spectrophotometric assay


Bioorg Med Chem 17: 4921-7 (2009)


Article DOI: 10.1016/j.bmc.2009.06.002
BindingDB Entry DOI: 10.7270/Q2XW4JV9
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
CAM-RNase A


(Bison bison (American bison))
BDBM50292723
PNG
((2R,3R,4R,5R)-2-(2,4-dioxo-3,4-dihydropyrimidin-1(...)
Show SMILES OC[C@H]1O[C@H]([C@H](OP(O)(O)=O)[C@@H]1O)n1ccc(=O)[nH]c1=O
Show InChI InChI=1S/C9H13N2O9P/c12-3-4-6(14)7(20-21(16,17)18)8(19-4)11-2-1-5(13)10-9(11)15/h1-2,4,6-8,12,14H,3H2,(H,10,13,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1
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7.10E+3n/an/an/an/an/an/an/an/a



Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic RNase A by spectrophotometric method


J Med Chem 52: 932-42 (2009)


Article DOI: 10.1021/jm800724t
BindingDB Entry DOI: 10.7270/Q2H99570
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
CAM-RNase A


(Bison bison (American bison))
BDBM50292723
PNG
((2R,3R,4R,5R)-2-(2,4-dioxo-3,4-dihydropyrimidin-1(...)
Show SMILES OC[C@H]1O[C@H]([C@H](OP(O)(O)=O)[C@@H]1O)n1ccc(=O)[nH]c1=O
Show InChI InChI=1S/C9H13N2O9P/c12-3-4-6(14)7(20-21(16,17)18)8(19-4)11-2-1-5(13)10-9(11)15/h1-2,4,6-8,12,14H,3H2,(H,10,13,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1
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1.16E+4n/an/an/an/an/an/an/an/a



National Hellenic Research Foundation

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic ribonuclease A assessed as enzyme activity by spectrophotometric method pH 6


Eur J Med Chem 44: 4496-508 (2009)


Article DOI: 10.1016/j.ejmech.2009.06.039
BindingDB Entry DOI: 10.7270/Q26H4HJJ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
CAM-RNase A


(Bison bison (American bison))
BDBM50233301
PNG
(CHEMBL258728 | cytidine-3'-monophosphate)
Show SMILES Nc1ccn([C@@H]2O[C@H](CO)[C@@H](OP(O)(O)=O)[C@H]2O)c(=O)n1
Show InChI InChI=1S/C9H14N3O8P/c10-5-1-2-12(9(15)11-5)8-6(14)7(4(3-13)19-8)20-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H2,10,11,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1
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2.01E+4n/an/an/an/an/an/an/an/a



National Hellenic Research Foundation

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic ribonuclease A assessed as enzyme activity by spectrophotometric method pH 6


Eur J Med Chem 44: 4496-508 (2009)


Article DOI: 10.1016/j.ejmech.2009.06.039
BindingDB Entry DOI: 10.7270/Q26H4HJJ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
CAM-RNase A


(Bison bison (American bison))
BDBM50438455
PNG
(CHEMBL2414522)
Show SMILES Cc1cn([C@H]2C[C@@H]([C@@H](CS(=O)(=O)CC(O)=O)O2)S(=O)(=O)CC(O)=O)c(=O)[nH]c1=O
Show InChI InChI=1S/C14H18N2O11S2/c1-7-3-16(14(22)15-13(7)21)10-2-9(29(25,26)6-12(19)20)8(27-10)4-28(23,24)5-11(17)18/h3,8-10H,2,4-6H2,1H3,(H,17,18)(H,19,20)(H,15,21,22)/t8-,9+,10-/m1/s1
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2.50E+4n/an/an/an/an/an/an/an/a



Institute of Technology Kharagpur

Curated by ChEMBL


Assay Description
Reversible competitive inhibition of bovine pancreatic RNase A using 2',3'-cCMP as substrate by Lineweaver-Burk plot analysis


Bioorg Med Chem 21: 4634-45 (2013)


Article DOI: 10.1016/j.bmc.2013.05.047
BindingDB Entry DOI: 10.7270/Q2WQ056P
More data for this
Ligand-Target Pair
CAM-RNase A


(Bison bison (American bison))
BDBM50331790
PNG
(3-Amino-N-[2-hydroxymethyl-5-(5-methyl-2,4-dioxo-3...)
Show SMILES Cc1cn([C@H]2C[C@H](NC(=O)C(N)CC(O)=O)[C@@H](CO)O2)c(=O)[nH]c1=O
Show InChI InChI=1S/C14H20N4O7/c1-6-4-18(14(24)17-12(6)22)10-3-8(9(5-19)25-10)16-13(23)7(15)2-11(20)21/h4,7-10,19H,2-3,5,15H2,1H3,(H,16,23)(H,20,21)(H,17,22,24)/t7?,8-,9+,10+/m0/s1
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3.70E+4n/an/an/an/an/an/an/an/a



Institute of Technology

Curated by ChEMBL


Assay Description
Competitive inhibition of bovine pancreatic RNase A ribonucleolytic activity of by Dixon plot analysis


Bioorg Med Chem 18: 8257-63 (2010)


Article DOI: 10.1016/j.bmc.2010.10.005
BindingDB Entry DOI: 10.7270/Q22807V3
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
CAM-RNase A


(Bison bison (American bison))
BDBM50438453
PNG
(CHEMBL2414524)
Show SMILES Cc1cn([C@H]2C[C@H]([C@@H](CS(=O)(=O)CC(O)=O)O2)S(=O)(=O)CC(O)=O)c(=O)[nH]c1=O
Show InChI InChI=1S/C14H18N2O11S2/c1-7-3-16(14(22)15-13(7)21)10-2-9(29(25,26)6-12(19)20)8(27-10)4-28(23,24)5-11(17)18/h3,8-10H,2,4-6H2,1H3,(H,17,18)(H,19,20)(H,15,21,22)/t8-,9-,10-/m1/s1
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3.90E+4n/an/an/an/an/an/an/an/a



Institute of Technology Kharagpur

Curated by ChEMBL


Assay Description
Reversible competitive inhibition of bovine pancreatic RNase A using 2',3'-cCMP as substrate by Lineweaver-Burk plot analysis


Bioorg Med Chem 21: 4634-45 (2013)


Article DOI: 10.1016/j.bmc.2013.05.047
BindingDB Entry DOI: 10.7270/Q2WQ056P
More data for this
Ligand-Target Pair
CAM-RNase A


(Bison bison (American bison))
BDBM173610
PNG
(9-[3'-[4-[(Uracil-1-yl)methyl]-1,2,3-triazol-1...)
Show SMILES OC[C@H]1O[C@H](C(O)[C@H]1n1cc(Cn2ccc(=O)[nH]c2=O)nn1)n1cnc2c(NC(=O)c3ccccc3)ncnc12
Show InChI InChI=1S/C24H22N10O6/c35-10-15-18(34-9-14(30-31-34)8-32-7-6-16(36)28-24(32)39)19(37)23(40-15)33-12-27-17-20(25-11-26-21(17)33)29-22(38)13-4-2-1-3-5-13/h1-7,9,11-12,15,18-19,23,35,37H,8,10H2,(H,28,36,39)(H,25,26,29,38)/t15-,18+,19?,23-/m1/s1
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5.55E+4n/an/an/an/an/an/an/an/a



University of Thessaly



Assay Description
The Ribonuclease Activity assay used was adapted from the procedure described by Anfinsen et al. and Slifman et al. Determination of ribonuclease act...


Bioorg Chem 63: 152-65 (2015)


Article DOI: 10.1016/j.bioorg.2015.10.007
BindingDB Entry DOI: 10.7270/Q27H1HCG
More data for this
Ligand-Target Pair
CAM-RNase A


(Bison bison (American bison))
BDBM50342006
PNG
(5'-Deoxy-5'-N-(4-carboxypiperidinyl)uridine | CHEM...)
Show SMILES O[C@@H]1[C@@H](CN2CCC(CC2)C(O)=O)O[C@H]([C@@H]1O)n1ccc(=O)[nH]c1=O
Show InChI InChI=1S/C15H21N3O7/c19-10-3-6-18(15(24)16-10)13-12(21)11(20)9(25-13)7-17-4-1-8(2-5-17)14(22)23/h3,6,8-9,11-13,20-21H,1-2,4-5,7H2,(H,22,23)(H,16,19,24)/t9-,11-,12-,13-/m1/s1
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6.10E+4n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic RNase A using 2',3'-cCMP as a substrate by Dixon plot analysis


Bioorg Med Chem 19: 2478-84 (2011)


Article DOI: 10.1016/j.bmc.2010.08.059
BindingDB Entry DOI: 10.7270/Q2736R7B
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
CAM-RNase A


(Bison bison (American bison))
BDBM50331791
PNG
((2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydr...)
Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@@H]([C@@H](O)[C@H]1O)C(O)=O
Show InChI InChI=1S/C10H11N5O5/c11-7-3-8(13-1-12-7)15(2-14-3)9-5(17)4(16)6(20-9)10(18)19/h1-2,4-6,9,16-17H,(H,18,19)(H2,11,12,13)/t4-,5+,6-,9+/m0/s1
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6.70E+4n/an/an/an/an/an/an/an/a



Institute of Technology

Curated by ChEMBL


Assay Description
Competitive inhibition of bovine pancreatic RNase A ribonucleolytic activity of by Dixon plot analysis


Bioorg Med Chem 18: 8257-63 (2010)


Article DOI: 10.1016/j.bmc.2010.10.005
BindingDB Entry DOI: 10.7270/Q22807V3
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
CAM-RNase A


(Bison bison (American bison))
BDBM173614
PNG
(9-[3'-[4-[(Thymine-1-yl)methyl]-1,2,3-triazol-...)
Show SMILES Cc1cn(Cc2cn(nn2)[C@H]2[C@@H](CO)O[C@H](C2O)N2C=NC3C2N=CN=C3N)c(=O)[nH]c1=O
Show InChI InChI=1S/C18H22N10O5/c1-8-2-26(18(32)23-16(8)31)3-9-4-28(25-24-9)12-10(5-29)33-17(13(12)30)27-7-22-11-14(19)20-6-21-15(11)27/h2,4,6-7,10-13,15,17,29-30H,3,5H2,1H3,(H2,19,20,21)(H,23,31,32)/t10-,11?,12+,13?,15?,17-/m1/s1
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6.88E+4n/an/an/an/an/an/an/an/a



University of Thessaly



Assay Description
The Ribonuclease Activity assay used was adapted from the procedure described by Anfinsen et al. and Slifman et al. Determination of ribonuclease act...


Bioorg Chem 63: 152-65 (2015)


Article DOI: 10.1016/j.bioorg.2015.10.007
BindingDB Entry DOI: 10.7270/Q27H1HCG
More data for this
Ligand-Target Pair
CAM-RNase A


(Bison bison (American bison))
BDBM50342006
PNG
(5'-Deoxy-5'-N-(4-carboxypiperidinyl)uridine | CHEM...)
Show SMILES O[C@@H]1[C@@H](CN2CCC(CC2)C(O)=O)O[C@H]([C@@H]1O)n1ccc(=O)[nH]c1=O
Show InChI InChI=1S/C15H21N3O7/c19-10-3-6-18(15(24)16-10)13-12(21)11(20)9(25-13)7-17-4-1-8(2-5-17)14(22)23/h3,6,8-9,11-13,20-21H,1-2,4-5,7H2,(H,22,23)(H,16,19,24)/t9-,11-,12-,13-/m1/s1
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7.50E+4n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic RNase A using 2',3'-cCMP as a substrate by Lineweaver-Burk analysis


Bioorg Med Chem 19: 2478-84 (2011)


Article DOI: 10.1016/j.bmc.2010.08.059
BindingDB Entry DOI: 10.7270/Q2736R7B
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
CAM-RNase A


(Bison bison (American bison))
BDBM50292715
PNG
(5'-deoxy-5'-N-(ethyl isonipecotatyl)uridine | CHEM...)
Show SMILES CCOC(=O)C1CCN(C[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2ccc(=O)[nH]c2=O)CC1
Show InChI InChI=1S/C17H25N3O7/c1-2-26-16(24)10-3-6-19(7-4-10)9-11-13(22)14(23)15(27-11)20-8-5-12(21)18-17(20)25/h5,8,10-11,13-15,22-23H,2-4,6-7,9H2,1H3,(H,18,21,25)/t11-,13-,14-,15-/m1/s1
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7.70E+4n/an/an/an/an/an/an/an/a



Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic RNase A by spectrophotometric method


J Med Chem 52: 932-42 (2009)


Article DOI: 10.1021/jm800724t
BindingDB Entry DOI: 10.7270/Q2H99570
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
CAM-RNase A


(Bison bison (American bison))
BDBM50292722
PNG
(3'-UMP | 3'-uridylic acid | CHEMBL460741)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)n1ccc(=O)[nH]c1=O
Show InChI InChI=1S/C9H13N2O9P/c12-3-4-7(20-21(16,17)18)6(14)8(19-4)11-2-1-5(13)10-9(11)15/h1-2,4,6-8,12,14H,3H2,(H,10,13,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1
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7.85E+4n/an/an/an/an/an/an/an/a



National Hellenic Research Foundation

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic ribonuclease A assessed as enzyme activity by spectrophotometric method pH 6


Eur J Med Chem 44: 4496-508 (2009)


Article DOI: 10.1016/j.ejmech.2009.06.039
BindingDB Entry DOI: 10.7270/Q26H4HJJ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
CAM-RNase A


(Bison bison (American bison))
BDBM50298713
PNG
(2',3'-Dideoxy-3'-L-serinylamino thymidine | CHEMBL...)
Show SMILES Cc1cn(C[C@H]2C[C@H](NC(=O)C(N)CO)[C@@H](CO)O2)c(=O)[nH]c1=O
Show InChI InChI=1S/C14H22N4O6/c1-7-3-18(14(23)17-12(7)21)4-8-2-10(11(6-20)24-8)16-13(22)9(15)5-19/h3,8-11,19-20H,2,4-6,15H2,1H3,(H,16,22)(H,17,21,23)/t8-,9?,10+,11-/m1/s1
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8.00E+4n/an/an/an/an/an/an/an/a



Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic RNase A by spectrophotometric assay


Bioorg Med Chem 17: 4921-7 (2009)


Article DOI: 10.1016/j.bmc.2009.06.002
BindingDB Entry DOI: 10.7270/Q2XW4JV9
More data for this
Ligand-Target Pair
CAM-RNase A


(Bison bison (American bison))
BDBM50292722
PNG
(3'-UMP | 3'-uridylic acid | CHEMBL460741)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)n1ccc(=O)[nH]c1=O
Show InChI InChI=1S/C9H13N2O9P/c12-3-4-7(20-21(16,17)18)6(14)8(19-4)11-2-1-5(13)10-9(11)15/h1-2,4,6-8,12,14H,3H2,(H,10,13,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1
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8.20E+4n/an/an/an/an/an/an/an/a



Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic RNase A by spectrophotometric method


J Med Chem 52: 932-42 (2009)


Article DOI: 10.1021/jm800724t
BindingDB Entry DOI: 10.7270/Q2H99570
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
CAM-RNase A


(Bison bison (American bison))
BDBM50438456
PNG
(CHEMBL2414521)
Show SMILES Cc1cn([C@H]2C[C@@H]([C@@H](CO)O2)S(=O)(=O)CC(O)=O)c(=O)[nH]c1=O
Show InChI InChI=1S/C12H16N2O8S/c1-6-3-14(12(19)13-11(6)18)9-2-8(7(4-15)22-9)23(20,21)5-10(16)17/h3,7-9,15H,2,4-5H2,1H3,(H,16,17)(H,13,18,19)/t7-,8+,9-/m1/s1
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8.80E+4n/an/an/an/an/an/an/an/a



Institute of Technology Kharagpur

Curated by ChEMBL


Assay Description
Reversible competitive inhibition of bovine pancreatic RNase A using 2',3'-cCMP as substrate by Lineweaver-Burk plot analysis


Bioorg Med Chem 21: 4634-45 (2013)


Article DOI: 10.1016/j.bmc.2013.05.047
BindingDB Entry DOI: 10.7270/Q2WQ056P
More data for this
Ligand-Target Pair
CAM-RNase A


(Bison bison (American bison))
BDBM50438454
PNG
(CHEMBL2414523)
Show SMILES Cc1cn([C@H]2C[C@H](SCC(O)=O)[C@@H](CSCC(O)=O)O2)c(=O)[nH]c1=O
Show InChI InChI=1S/C14H18N2O7S2/c1-7-3-16(14(22)15-13(7)21)10-2-9(25-6-12(19)20)8(23-10)4-24-5-11(17)18/h3,8-10H,2,4-6H2,1H3,(H,17,18)(H,19,20)(H,15,21,22)/t8-,9+,10-/m1/s1
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9.30E+4n/an/an/an/an/an/an/an/a



Institute of Technology Kharagpur

Curated by ChEMBL


Assay Description
Reversible competitive inhibition of bovine pancreatic RNase A using 2',3'-cCMP as substrate by Lineweaver-Burk plot analysis


Bioorg Med Chem 21: 4634-45 (2013)


Article DOI: 10.1016/j.bmc.2013.05.047
BindingDB Entry DOI: 10.7270/Q2WQ056P
More data for this
Ligand-Target Pair
CAM-RNase A


(Bison bison (American bison))
BDBM50438451
PNG
(CHEMBL2414510)
Show SMILES Cc1cn([C@H]2C[C@H](O)[C@@H](CS(=O)(=O)CC(O)=O)O2)c(=O)[nH]c1=O
Show InChI InChI=1S/C12H16N2O8S/c1-6-3-14(12(19)13-11(6)18)9-2-7(15)8(22-9)4-23(20,21)5-10(16)17/h3,7-9,15H,2,4-5H2,1H3,(H,16,17)(H,13,18,19)/t7-,8+,9+/m0/s1
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9.50E+4n/an/an/an/an/an/an/an/a



Institute of Technology Kharagpur

Curated by ChEMBL


Assay Description
Reversible competitive inhibition of bovine pancreatic RNase A using 2',3'-cCMP as substrate by Lineweaver-Burk plot analysis


Bioorg Med Chem 21: 4634-45 (2013)


Article DOI: 10.1016/j.bmc.2013.05.047
BindingDB Entry DOI: 10.7270/Q2WQ056P
More data for this
Ligand-Target Pair
CAM-RNase A


(Bison bison (American bison))
BDBM173612
PNG
(9-[3'-[4-[(Cytosine-1-yl)methyl]-1,2,3-triazol...)
Show SMILES NC1=NC=NC2C1N=CN2[C@@H]1O[C@H](CO)[C@@H](C1O)n1cc(Cn2ccc(N)nc2=O)nn1
Show InChI InChI=1S/C17H21N11O4/c18-10-1-2-26(17(31)23-10)3-8-4-28(25-24-8)12-9(5-29)32-16(13(12)30)27-7-22-11-14(19)20-6-21-15(11)27/h1-2,4,6-7,9,11-13,15-16,29-30H,3,5H2,(H2,18,23,31)(H2,19,20,21)/t9-,11?,12+,13?,15?,16-/m1/s1
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9.85E+4n/an/an/an/an/an/an/an/a



University of Thessaly



Assay Description
The Ribonuclease Activity assay used was adapted from the procedure described by Anfinsen et al. and Slifman et al. Determination of ribonuclease act...


Bioorg Chem 63: 152-65 (2015)


Article DOI: 10.1016/j.bioorg.2015.10.007
BindingDB Entry DOI: 10.7270/Q27H1HCG
More data for this
Ligand-Target Pair
CAM-RNase A


(Bison bison (American bison))
BDBM50233301
PNG
(CHEMBL258728 | cytidine-3'-monophosphate)
Show SMILES Nc1ccn([C@@H]2O[C@H](CO)[C@@H](OP(O)(O)=O)[C@H]2O)c(=O)n1
Show InChI InChI=1S/C9H14N3O8P/c10-5-1-2-12(9(15)11-5)8-6(14)7(4(3-13)19-8)20-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H2,10,11,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1
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1.03E+5n/an/an/an/an/an/an/an/a



Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic RNase A by spectrophotometric assay


Bioorg Med Chem 17: 4921-7 (2009)


Article DOI: 10.1016/j.bmc.2009.06.002
BindingDB Entry DOI: 10.7270/Q2XW4JV9
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
CAM-RNase A


(Bison bison (American bison))
BDBM50292714
PNG
(3'-N-piperidine-4-carboxyl-3'-deoxyara-uridine | C...)
Show SMILES OC[C@]1(O[C@H]([C@@H](O)[C@@H]1N1CCCCC1)n1ccc(=O)[nH]c1=O)C(O)=O
Show InChI InChI=1S/C15H21N3O7/c19-8-15(13(22)23)11(17-5-2-1-3-6-17)10(21)12(25-15)18-7-4-9(20)16-14(18)24/h4,7,10-12,19,21H,1-3,5-6,8H2,(H,22,23)(H,16,20,24)/t10-,11-,12+,15+/m0/s1
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1.03E+5n/an/an/an/an/an/an/an/a



Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic RNase A by spectrophotometric method


J Med Chem 52: 932-42 (2009)


Article DOI: 10.1021/jm800724t
BindingDB Entry DOI: 10.7270/Q2H99570
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
CAM-RNase A


(Bison bison (American bison))
BDBM50233301
PNG
(CHEMBL258728 | cytidine-3'-monophosphate)
Show SMILES Nc1ccn([C@@H]2O[C@H](CO)[C@@H](OP(O)(O)=O)[C@H]2O)c(=O)n1
Show InChI InChI=1S/C9H14N3O8P/c10-5-1-2-12(9(15)11-5)8-6(14)7(4(3-13)19-8)20-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H2,10,11,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1
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1.03E+5n/an/an/an/an/an/an/an/a



Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic RNase A by spectrophotometric method


J Med Chem 52: 932-42 (2009)


Article DOI: 10.1021/jm800724t
BindingDB Entry DOI: 10.7270/Q2H99570
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
CAM-RNase A


(Bison bison (American bison))
BDBM173613
PNG
(9-[3'-[4-[(Uracil-1-yl)methyl]-1,2,3-triazol-1...)
Show SMILES NC1=NC=NC2C1N=CN2[C@@H]1O[C@H](CO)[C@@H](C1O)n1cc(Cn2ccc(=O)[nH]c2=O)nn1
Show InChI InChI=1S/C17H20N10O5/c18-14-11-15(20-6-19-14)26(7-21-11)16-13(30)12(9(5-28)32-16)27-4-8(23-24-27)3-25-2-1-10(29)22-17(25)31/h1-2,4,6-7,9,11-13,15-16,28,30H,3,5H2,(H2,18,19,20)(H,22,29,31)/t9-,11?,12+,13?,15?,16-/m1/s1
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1.06E+5n/an/an/an/an/an/an/an/a



University of Thessaly



Assay Description
The Ribonuclease Activity assay used was adapted from the procedure described by Anfinsen et al. and Slifman et al. Determination of ribonuclease act...


Bioorg Chem 63: 152-65 (2015)


Article DOI: 10.1016/j.bioorg.2015.10.007
BindingDB Entry DOI: 10.7270/Q27H1HCG
More data for this
Ligand-Target Pair
CAM-RNase A


(Bison bison (American bison))
BDBM50438452
PNG
(CHEMBL2414509)
Show SMILES Cc1cn([C@H]2C[C@@H](SCC(O)=O)[C@@H](CSCC(O)=O)O2)c(=O)[nH]c1=O
Show InChI InChI=1S/C14H18N2O7S2/c1-7-3-16(14(22)15-13(7)21)10-2-9(25-6-12(19)20)8(23-10)4-24-5-11(17)18/h3,8-10H,2,4-6H2,1H3,(H,17,18)(H,19,20)(H,15,21,22)/t8-,9-,10-/m1/s1
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1.08E+5n/an/an/an/an/an/an/an/a



Institute of Technology Kharagpur

Curated by ChEMBL


Assay Description
Reversible competitive inhibition of bovine pancreatic RNase A using 2',3'-cCMP as substrate by Lineweaver-Burk plot analysis


Bioorg Med Chem 21: 4634-45 (2013)


Article DOI: 10.1016/j.bmc.2013.05.047
BindingDB Entry DOI: 10.7270/Q2WQ056P
More data for this
Ligand-Target Pair
CAM-RNase A


(Bison bison (American bison))
BDBM50342007
PNG
(5'-Deoxy-5'-N-(4-carboxypiperidinyl)thymidine | CH...)
Show SMILES Cc1cn([C@H]2C[C@H](O)[C@@H](CN3CCC(CC3)C(O)=O)O2)c(=O)[nH]c1=O
Show InChI InChI=1S/C16H23N3O6/c1-9-7-19(16(24)17-14(9)21)13-6-11(20)12(25-13)8-18-4-2-10(3-5-18)15(22)23/h7,10-13,20H,2-6,8H2,1H3,(H,22,23)(H,17,21,24)/t11-,12+,13+/m0/s1
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1.21E+5n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic RNase A using 2',3'-cCMP as a substrate by Dixon plot analysis


Bioorg Med Chem 19: 2478-84 (2011)


Article DOI: 10.1016/j.bmc.2010.08.059
BindingDB Entry DOI: 10.7270/Q2736R7B
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
CAM-RNase A


(Bison bison (American bison))
BDBM50438448
PNG
(CHEMBL2414513)
Show SMILES COC(=O)CS(=O)(=O)[C@H]1C[C@@H](O[C@@H]1CO)n1cc(C)c(=O)[nH]c1=O
Show InChI InChI=1S/C13H18N2O8S/c1-7-4-15(13(19)14-12(7)18)10-3-9(8(5-16)23-10)24(20,21)6-11(17)22-2/h4,8-10,16H,3,5-6H2,1-2H3,(H,14,18,19)/t8-,9+,10-/m1/s1
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1.40E+5n/an/an/an/an/an/an/an/a



Institute of Technology Kharagpur

Curated by ChEMBL


Assay Description
Reversible competitive inhibition of bovine pancreatic RNase A using 2',3'-cCMP as substrate by Lineweaver-Burk plot analysis


Bioorg Med Chem 21: 4634-45 (2013)


Article DOI: 10.1016/j.bmc.2013.05.047
BindingDB Entry DOI: 10.7270/Q2WQ056P
More data for this
Ligand-Target Pair
CAM-RNase A


(Bison bison (American bison))
BDBM173611
PNG
(9-[3'-[4-[(Thymine-1-yl)methyl]-1,2,3-triazol-...)
Show SMILES Cc1cn(Cc2cn(nn2)[C@H]2[C@@H](CO)O[C@H](C2O)n2cnc3c(NC(=O)c4ccccc4)ncnc23)c(=O)[nH]c1=O
Show InChI InChI=1S/C25H24N10O6/c1-13-7-33(25(40)30-22(13)38)8-15-9-35(32-31-15)18-16(10-36)41-24(19(18)37)34-12-28-17-20(26-11-27-21(17)34)29-23(39)14-5-3-2-4-6-14/h2-7,9,11-12,16,18-19,24,36-37H,8,10H2,1H3,(H,30,38,40)(H,26,27,29,39)/t16-,18+,19?,24-/m1/s1
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1.50E+5n/an/an/an/an/an/an/an/a



University of Thessaly



Assay Description
The Ribonuclease Activity assay used was adapted from the procedure described by Anfinsen et al. and Slifman et al. Determination of ribonuclease act...


Bioorg Chem 63: 152-65 (2015)


Article DOI: 10.1016/j.bioorg.2015.10.007
BindingDB Entry DOI: 10.7270/Q27H1HCG
More data for this
Ligand-Target Pair
CAM-RNase A


(Bison bison (American bison))
BDBM173608
PNG
(1-[3'-[4-[(Adenine-9-yl)methyl]-1,2,3-triazol-...)
Show SMILES Nc1ncnc2n(Cc3cn(nn3)[C@H]3[C@@H](CO)O[C@H](C3O)n3ccc(=O)[nH]c3=O)cnc12
Show InChI InChI=1S/C17H18N10O5/c18-14-11-15(20-6-19-14)25(7-21-11)3-8-4-27(24-23-8)12-9(5-28)32-16(13(12)30)26-2-1-10(29)22-17(26)31/h1-2,4,6-7,9,12-13,16,28,30H,3,5H2,(H2,18,19,20)(H,22,29,31)/t9-,12+,13?,16-/m1/s1
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1.59E+5n/an/an/an/an/an/an/an/a



University of Thessaly



Assay Description
The Ribonuclease Activity assay used was adapted from the procedure described by Anfinsen et al. and Slifman et al. Determination of ribonuclease act...


Bioorg Chem 63: 152-65 (2015)


Article DOI: 10.1016/j.bioorg.2015.10.007
BindingDB Entry DOI: 10.7270/Q27H1HCG
More data for this
Ligand-Target Pair
CAM-RNase A


(Bison bison (American bison))
BDBM50342007
PNG
(5'-Deoxy-5'-N-(4-carboxypiperidinyl)thymidine | CH...)
Show SMILES Cc1cn([C@H]2C[C@H](O)[C@@H](CN3CCC(CC3)C(O)=O)O2)c(=O)[nH]c1=O
Show InChI InChI=1S/C16H23N3O6/c1-9-7-19(16(24)17-14(9)21)13-6-11(20)12(25-13)8-18-4-2-10(3-5-18)15(22)23/h7,10-13,20H,2-6,8H2,1H3,(H,22,23)(H,17,21,24)/t11-,12+,13+/m0/s1
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1.62E+5n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic RNase A using 2',3'-cCMP as a substrate by Lineweaver-Burk analysis


Bioorg Med Chem 19: 2478-84 (2011)


Article DOI: 10.1016/j.bmc.2010.08.059
BindingDB Entry DOI: 10.7270/Q2736R7B
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
CAM-RNase A


(Bison bison (American bison))
BDBM50438457
PNG
(CHEMBL2414520)
Show SMILES Cc1cn([C@H]2C[C@H](SCC(O)=O)[C@@H](CO)O2)c(=O)[nH]c1=O
Show InChI InChI=1S/C12H16N2O6S/c1-6-3-14(12(19)13-11(6)18)9-2-8(7(4-15)20-9)21-5-10(16)17/h3,7-9,15H,2,4-5H2,1H3,(H,16,17)(H,13,18,19)/t7-,8+,9-/m1/s1
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1.69E+5n/an/an/an/an/an/an/an/a



Institute of Technology Kharagpur

Curated by ChEMBL


Assay Description
Reversible competitive inhibition of bovine pancreatic RNase A using 2',3'-cCMP as substrate by Lineweaver-Burk plot analysis


Bioorg Med Chem 21: 4634-45 (2013)


Article DOI: 10.1016/j.bmc.2013.05.047
BindingDB Entry DOI: 10.7270/Q2WQ056P
More data for this
Ligand-Target Pair
CAM-RNase A


(Bison bison (American bison))
BDBM50292719
PNG
(5'-deoxy-5'-N-piperidinouridine | CHEMBL444258)
Show SMILES O[C@@H]1[C@@H](CN2CCCCC2)O[C@H]([C@@H]1O)n1ccc(=O)[nH]c1=O
Show InChI InChI=1S/C14H21N3O5/c18-10-4-7-17(14(21)15-10)13-12(20)11(19)9(22-13)8-16-5-2-1-3-6-16/h4,7,9,11-13,19-20H,1-3,5-6,8H2,(H,15,18,21)/t9-,11-,12-,13-/m1/s1
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1.72E+5n/an/an/an/an/an/an/an/a



Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic RNase A by spectrophotometric method


J Med Chem 52: 932-42 (2009)


Article DOI: 10.1021/jm800724t
BindingDB Entry DOI: 10.7270/Q2H99570
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
CAM-RNase A


(Bison bison (American bison))
BDBM50292720
PNG
(5'-deoxy-5'-N-morpholinouridine | CHEMBL460902)
Show SMILES O[C@@H]1[C@@H](CN2CCOCC2)O[C@H]([C@@H]1O)n1ccc(=O)[nH]c1=O
Show InChI InChI=1S/C13H19N3O6/c17-9-1-2-16(13(20)14-9)12-11(19)10(18)8(22-12)7-15-3-5-21-6-4-15/h1-2,8,10-12,18-19H,3-7H2,(H,14,17,20)/t8-,10-,11-,12-/m1/s1
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1.79E+5n/an/an/an/an/an/an/an/a



Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic RNase A by spectrophotometric method


J Med Chem 52: 932-42 (2009)


Article DOI: 10.1021/jm800724t
BindingDB Entry DOI: 10.7270/Q2H99570
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
CAM-RNase A


(Bison bison (American bison))
BDBM50342008
PNG
(1-[2,5-Dideoxy-5-(4-carboxypiperidinyl)-beta-D-thr...)
Show SMILES Cc1cn([C@H]2C[C@@H](O)[C@@H](CN3CCC(CC3)C(O)=O)O2)c(=O)[nH]c1=O
Show InChI InChI=1S/C16H23N3O6/c1-9-7-19(16(24)17-14(9)21)13-6-11(20)12(25-13)8-18-4-2-10(3-5-18)15(22)23/h7,10-13,20H,2-6,8H2,1H3,(H,22,23)(H,17,21,24)/t11-,12-,13-/m1/s1
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1.83E+5n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic RNase A using 2',3'-cCMP as a substrate by Dixon plot analysis


Bioorg Med Chem 19: 2478-84 (2011)


Article DOI: 10.1016/j.bmc.2010.08.059
BindingDB Entry DOI: 10.7270/Q2736R7B
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
CAM-RNase A


(Bison bison (American bison))
BDBM50438458
PNG
(CHEMBL2414519)
Show SMILES Cc1cn([C@H]2C[C@H](NCC(O)=O)[C@@H](CO)O2)c(=O)[nH]c1=O
Show InChI InChI=1S/C12H17N3O6/c1-6-4-15(12(20)14-11(6)19)9-2-7(8(5-16)21-9)13-3-10(17)18/h4,7-9,13,16H,2-3,5H2,1H3,(H,17,18)(H,14,19,20)/t7-,8+,9+/m0/s1
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1.86E+5n/an/an/an/an/an/an/an/a



Institute of Technology Kharagpur

Curated by ChEMBL


Assay Description
Reversible competitive inhibition of bovine pancreatic RNase A using 2',3'-cCMP as substrate by Lineweaver-Burk plot analysis


Bioorg Med Chem 21: 4634-45 (2013)


Article DOI: 10.1016/j.bmc.2013.05.047
BindingDB Entry DOI: 10.7270/Q2WQ056P
More data for this
Ligand-Target Pair
CAM-RNase A


(Bison bison (American bison))
BDBM50331792
PNG
(5'-Carboxy thymidine | CHEMBL1288589)
Show SMILES Cc1cn([C@H]2C[C@H](O)[C@H](O2)C(O)=O)c(=O)[nH]c1=O
Show InChI InChI=1S/C10H12N2O6/c1-4-3-12(10(17)11-8(4)14)6-2-5(13)7(18-6)9(15)16/h3,5-7,13H,2H2,1H3,(H,15,16)(H,11,14,17)/t5-,6+,7-/m0/s1
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1.93E+5n/an/an/an/an/an/an/an/a



Institute of Technology

Curated by ChEMBL


Assay Description
Competitive inhibition of bovine pancreatic RNase A ribonucleolytic activity of by Dixon plot analysis


Bioorg Med Chem 18: 8257-63 (2010)


Article DOI: 10.1016/j.bmc.2010.10.005
BindingDB Entry DOI: 10.7270/Q22807V3
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
CAM-RNase A


(Bison bison (American bison))
BDBM50438445
PNG
(CHEMBL2414517)
Show SMILES COC(=O)CS(=O)(=O)C[C@H]1O[C@H](C[C@@H]1O)n1cc(C)c(=O)[nH]c1=O
Show InChI InChI=1S/C13H18N2O8S/c1-7-4-15(13(19)14-12(7)18)10-3-8(16)9(23-10)5-24(20,21)6-11(17)22-2/h4,8-10,16H,3,5-6H2,1-2H3,(H,14,18,19)/t8-,9+,10+/m0/s1
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2.02E+5n/an/an/an/an/an/an/an/a



Institute of Technology Kharagpur

Curated by ChEMBL


Assay Description
Reversible competitive inhibition of bovine pancreatic RNase A using 2',3'-cCMP as substrate by Lineweaver-Burk plot analysis


Bioorg Med Chem 21: 4634-45 (2013)


Article DOI: 10.1016/j.bmc.2013.05.047
BindingDB Entry DOI: 10.7270/Q2WQ056P
More data for this
Ligand-Target Pair
CAM-RNase A


(Bison bison (American bison))
BDBM50292718
PNG
(5'-deoxy-5'-N-pyrrolidinouridine | CHEMBL513623)
Show SMILES O[C@@H]1[C@@H](CN2CCCC2)O[C@H]([C@@H]1O)n1ccc(=O)[nH]c1=O
Show InChI InChI=1S/C13H19N3O5/c17-9-3-6-16(13(20)14-9)12-11(19)10(18)8(21-12)7-15-4-1-2-5-15/h3,6,8,10-12,18-19H,1-2,4-5,7H2,(H,14,17,20)/t8-,10-,11-,12-/m1/s1
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2.03E+5n/an/an/an/an/an/an/an/a



Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic RNase A by spectrophotometric method


J Med Chem 52: 932-42 (2009)


Article DOI: 10.1021/jm800724t
BindingDB Entry DOI: 10.7270/Q2H99570
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
CAM-RNase A


(Bison bison (American bison))
BDBM50342008
PNG
(1-[2,5-Dideoxy-5-(4-carboxypiperidinyl)-beta-D-thr...)
Show SMILES Cc1cn([C@H]2C[C@@H](O)[C@@H](CN3CCC(CC3)C(O)=O)O2)c(=O)[nH]c1=O
Show InChI InChI=1S/C16H23N3O6/c1-9-7-19(16(24)17-14(9)21)13-6-11(20)12(25-13)8-18-4-2-10(3-5-18)15(22)23/h7,10-13,20H,2-6,8H2,1H3,(H,22,23)(H,17,21,24)/t11-,12-,13-/m1/s1
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2.29E+5n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic RNase A using 2',3'-cCMP as a substrate by Lineweaver-Burk analysis


Bioorg Med Chem 19: 2478-84 (2011)


Article DOI: 10.1016/j.bmc.2010.08.059
BindingDB Entry DOI: 10.7270/Q2736R7B
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
CAM-RNase A


(Bison bison (American bison))
BDBM50438446
PNG
(CHEMBL2414515)
Show SMILES COC(=O)CS(=O)(=O)C[C@H]1O[C@H](C[C@H]1S(=O)(=O)CC(=O)OC)n1cc(C)c(=O)[nH]c1=O
Show InChI InChI=1S/C16H22N2O11S2/c1-9-5-18(16(22)17-15(9)21)12-4-11(31(25,26)8-14(20)28-3)10(29-12)6-30(23,24)7-13(19)27-2/h5,10-12H,4,6-8H2,1-3H3,(H,17,21,22)/t10-,11-,12-/m1/s1
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2.42E+5n/an/an/an/an/an/an/an/a



Institute of Technology Kharagpur

Curated by ChEMBL


Assay Description
Reversible competitive inhibition of bovine pancreatic RNase A using 2',3'-cCMP as substrate by Lineweaver-Burk plot analysis


Bioorg Med Chem 21: 4634-45 (2013)


Article DOI: 10.1016/j.bmc.2013.05.047
BindingDB Entry DOI: 10.7270/Q2WQ056P
More data for this
Ligand-Target Pair
CAM-RNase A


(Bison bison (American bison))
BDBM50342009
PNG
(5'-N-(4-Carboxypiperidinyl)-2',3'-didehydro-3',5'-...)
Show SMILES Cc1cn([C@@H]2O[C@H](CN3CCC(CC3)C(O)=O)C=C2)c(=O)[nH]c1=O
Show InChI InChI=1S/C16H21N3O5/c1-10-8-19(16(23)17-14(10)20)13-3-2-12(24-13)9-18-6-4-11(5-7-18)15(21)22/h2-3,8,11-13H,4-7,9H2,1H3,(H,21,22)(H,17,20,23)/t12-,13+/m0/s1
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2.50E+5n/an/an/an/an/an/an/an/a



Indian Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic RNase A using 2',3'-cCMP as a substrate by Lineweaver-Burk analysis


Bioorg Med Chem 19: 2478-84 (2011)


Article DOI: 10.1016/j.bmc.2010.08.059
BindingDB Entry DOI: 10.7270/Q2736R7B
More data for this
Ligand-Target Pair
CAM-RNase A


(Bison bison (American bison))
BDBM173609
PNG
(1-[3'-[4-[(Adenine-9-yl)methyl]-1,2,3-triazol-...)
Show SMILES Nc1ncnc2n(Cc3cn(nn3)[C@H]3[C@@H](CO)O[C@H](C3O)n3cc(F)c(=O)[nH]c3=O)cnc12
Show InChI InChI=1S/C17H17FN10O5/c18-8-3-27(17(32)23-15(8)31)16-12(30)11(9(4-29)33-16)28-2-7(24-25-28)1-26-6-22-10-13(19)20-5-21-14(10)26/h2-3,5-6,9,11-12,16,29-30H,1,4H2,(H2,19,20,21)(H,23,31,32)/t9-,11+,12?,16-/m1/s1
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2.65E+5n/an/an/an/an/an/an/an/a



University of Thessaly



Assay Description
The Ribonuclease Activity assay used was adapted from the procedure described by Anfinsen et al. and Slifman et al. Determination of ribonuclease act...


Bioorg Chem 63: 152-65 (2015)


Article DOI: 10.1016/j.bioorg.2015.10.007
BindingDB Entry DOI: 10.7270/Q27H1HCG
More data for this
Ligand-Target Pair
CAM-RNase A


(Bison bison (American bison))
BDBM50438447
PNG
(CHEMBL2414514)
Show SMILES COC(=O)CS(=O)(=O)C[C@H]1O[C@H](C[C@@H]1S(=O)(=O)CC(=O)OC)n1cc(C)c(=O)[nH]c1=O
Show InChI InChI=1S/C16H22N2O11S2/c1-9-5-18(16(22)17-15(9)21)12-4-11(31(25,26)8-14(20)28-3)10(29-12)6-30(23,24)7-13(19)27-2/h5,10-12H,4,6-8H2,1-3H3,(H,17,21,22)/t10-,11+,12-/m1/s1
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2.67E+5n/an/an/an/an/an/an/an/a



Institute of Technology Kharagpur

Curated by ChEMBL


Assay Description
Reversible competitive inhibition of bovine pancreatic RNase A using 2',3'-cCMP as substrate by Lineweaver-Burk plot analysis


Bioorg Med Chem 21: 4634-45 (2013)


Article DOI: 10.1016/j.bmc.2013.05.047
BindingDB Entry DOI: 10.7270/Q2WQ056P
More data for this
Ligand-Target Pair
CAM-RNase A


(Bison bison (American bison))
BDBM50438459
PNG
(CHEMBL2414518)
Show SMILES Cc1cn([C@H]2C[C@H](OCC(O)=O)[C@@H](CO)O2)c(=O)[nH]c1=O
Show InChI InChI=1S/C12H16N2O7/c1-6-3-14(12(19)13-11(6)18)9-2-7(8(4-15)21-9)20-5-10(16)17/h3,7-9,15H,2,4-5H2,1H3,(H,16,17)(H,13,18,19)/t7-,8+,9+/m0/s1
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2.67E+5n/an/an/an/an/an/an/an/a



Institute of Technology Kharagpur

Curated by ChEMBL


Assay Description
Reversible competitive inhibition of bovine pancreatic RNase A using 2',3'-cCMP as substrate by Lineweaver-Burk plot analysis


Bioorg Med Chem 21: 4634-45 (2013)


Article DOI: 10.1016/j.bmc.2013.05.047
BindingDB Entry DOI: 10.7270/Q2WQ056P
More data for this
Ligand-Target Pair
CAM-RNase A


(Bison bison (American bison))
BDBM50292717
PNG
(5'-deoxy-5'-N-piperidinothymidine | 5'-deoxy-5'-pi...)
Show SMILES Cc1cn([C@H]2C[C@H](O)[C@@H](CN3CCCCC3)O2)c(=O)[nH]c1=O
Show InChI InChI=1S/C15H23N3O4/c1-10-8-18(15(21)16-14(10)20)13-7-11(19)12(22-13)9-17-5-3-2-4-6-17/h8,11-13,19H,2-7,9H2,1H3,(H,16,20,21)/t11-,12+,13+/m0/s1
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3.96E+5n/an/an/an/an/an/an/an/a



Institute of Technology

Curated by ChEMBL


Assay Description
Inhibition of bovine pancreatic RNase A by spectrophotometric method


J Med Chem 52: 932-42 (2009)


Article DOI: 10.1021/jm800724t
BindingDB Entry DOI: 10.7270/Q2H99570
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
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