× Home Simple Search Query Builder Structure Search Browse SAVIOR's Stats Properties Priority Inhibitors Similarity with FDA Approved Drugs Similarity with ChEMBL compounds Similarity with ZINC Lead-like compounds Cluster Visualization Submission Useful Resources Contact Us
SAVIOR Search
Record - 1 of 8   [TOP]
Inhibitor IDSARSCOV2-0119
Inhibitor NameDigitoxin
FormulaC41H64O13
SMILES[H][C@@]1(CC[C@]2(O)[C@]3([H])CC[C@]4([H])C[C@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)O[C@H]1C[C@H](O)[C@H](O[C@H]2C[C@H](O)[C@H](O[C@H]3C[C@H](O)[C@H](O)[C@@H](C)O3)[C@@H](C)O2)[C@@H](C)O1)C1=CC(=O)OC1
Inhibitor Structure
DOWNLOAD:
PubChem ID 441207
Drug Bank ID DB01396
ChemSpider ID 
Virus_Target2'-O-ribose methyltransferase (accession YP_009725311.1)
Virus Target ID
Host Target
Host Target Id
GO Code
Cell line
In-vivo Testin silico
Outcomestrong binding in the active site of 2'OMTase
Molecular Weight764.95
IC50 (in uM)
EC50 (in uM)
Kd(in nM)
H-bond Acceptor12
H-bond Donor5
No. of Rotatable Bond Count7
XLogP3.60
PSA182.8
Bio Availabilityfalse
Lead Likenessfalse
New Inhibitor (NR) / Repurposed Drug (RD)Repurposing
Reference(s)https://chemrxiv.org/articles/Computational_Guided_Drug_Repurposing_for_Targeting_2_-O-Ribose_Methyltransferase_of_SARS-CoV-2/12111138/1
DOI https://doi.org/10.26434/chemrxiv.12111138.v1
Curator NameAnkita
Curatorshukla.ankita39@gmail.com


Record - 2 of 8   [TOP]
Inhibitor IDSARSCOV2-0120
Inhibitor NameDihydroergotamine
FormulaC33H37N5O5
SMILES[H][C@@]12CCCN1C(=O)[C@H](CC1=CC=CC=C1)N1C(=O)[C@](C)(NC(=O)[C@H]3CN(C)[C@]4([H])CC5=CNC6=CC=CC(=C56)[C@@]4([H])C3)O[C@@]21O
Inhibitor Structure
DOWNLOAD:
PubChem ID 10531
Drug Bank ID DB00320 (APRD00476, DB05743)
ChemSpider ID 
Virus_Target2'-O-ribose methyltransferase (accession YP_009725311.1)
Virus Target ID
Host Target
Host Target Id
GO Code
Cell line
In-vivo Testin silico
Outcomestrong binding in the active site of 2'OMTase
Molecular Weight583.69
IC50 (in uM)
EC50 (in uM)
Kd(in nM)
H-bond Acceptor6
H-bond Donor3
No. of Rotatable Bond Count4
XLogP2.71
PSA118.2
Bio Availabilitytrue
Lead Likenessfalse
New Inhibitor (NR) / Repurposed Drug (RD)Repurposing
Reference(s)https://chemrxiv.org/articles/Computational_Guided_Drug_Repurposing_for_Targeting_2_-O-Ribose_Methyltransferase_of_SARS-CoV-2/12111138/1
DOI https://doi.org/10.26434/chemrxiv.12111138.v1
Curator NameAnkita
Curatorshukla.ankita39@gmail.com


Record - 3 of 8   [TOP]
Inhibitor IDSARSCOV2-0135
Inhibitor NameErgotamine
FormulaC33H35N5O5
SMILES[H][C@@]12CCCN1C(=O)[C@H](CC1=CC=CC=C1)N1C(=O)[C@](C)(NC(=O)[C@H]3CN(C)[C@]4([H])CC5=CNC6=CC=CC(=C56)C4=C3)O[C@@]21O
Inhibitor Structure
DOWNLOAD:
PubChem ID 8223
Drug Bank ID DB00696 (APRD00677)
ChemSpider ID 
Virus_Target2'-O-ribose methyltransferase (accession YP_009725311.1)
Virus Target ID
Host Target
Host Target Id
GO Code
Cell line
In-vivo Testin silico
Outcomestrong binding in the active site of 2'OMTase
Molecular Weight581.67
IC50 (in uM)
EC50 (in uM)
Kd(in nM)
H-bond Acceptor6
H-bond Donor3
No. of Rotatable Bond Count4
XLogP2.60
PSA118.2
Bio Availabilitytrue
Lead Likenessfalse
New Inhibitor (NR) / Repurposed Drug (RD)Repurposing
Reference(s)https://chemrxiv.org/articles/Computational_Guided_Drug_Repurposing_for_Targeting_2_-O-Ribose_Methyltransferase_of_SARS-CoV-2/12111138/1
DOI https://doi.org/10.26434/chemrxiv.12111138.v1
Curator NameAnkita
Curatorshukla.ankita39@gmail.com


Record - 4 of 8   [TOP]
Inhibitor IDSARSCOV2-0136
Inhibitor NameEribulin
FormulaC40H59NO11
SMILES[H][C@@]12CC(=C)[C@]([H])(CC[C@@]3([H])C[C@@H](C)C(=C)[C@@]([H])(C[C@]4([H])O[C@H](C[C@H](O)CN)[C@H](OC)[C@@]4([H])CC(=O)C[C@@]4([H])CC[C@]5([H])O[C@@]6([H])[C@H]7O[C@@]8(C[C@]7([H])O[C@@]6([H])[C@@]([H])(O8)[C@@]5([H])O4)CC1)O3)O2
Inhibitor Structure
DOWNLOAD:
PubChem ID 11354606
Drug Bank ID DB08871 (DB04940)
ChemSpider ID 
Virus_Target2'-O-ribose methyltransferase (accession YP_009725311.1)
Virus Target ID
Host Target
Host Target Id
GO Code
Cell line
In-vivo Testin silico
Outcomestrong binding in the active site of 2'OMTase
Molecular Weight729.91
IC50 (in uM)
EC50 (in uM)
Kd(in nM)
H-bond Acceptor12
H-bond Donor2
No. of Rotatable Bond Count4
XLogP2.31
PSA146.3
Bio Availabilityfalse
Lead Likenessfalse
New Inhibitor (NR) / Repurposed Drug (RD)Repurposing
Reference(s)https://chemrxiv.org/articles/Computational_Guided_Drug_Repurposing_for_Targeting_2_-O-Ribose_Methyltransferase_of_SARS-CoV-2/12111138/1
DOI https://doi.org/10.26434/chemrxiv.12111138.v1
Curator NameAnkita
Curatorshukla.ankita39@gmail.com


Record - 5 of 8   [TOP]
Inhibitor IDSARSCOV2-0175
Inhibitor NameIrinotecan
FormulaC33H38N4O6
SMILESCCC1=C2CN3C(=CC4=C(COC(=O)[C@]4(O)CC)C3=O)C2=NC2=CC=C(OC(=O)N3CCC(CC3)N3CCCCC3)C=C12
Inhibitor Structure
DOWNLOAD:
PubChem ID 60838
Drug Bank ID DB00762 (APRD00579)
ChemSpider ID 
Virus_Target2'-O-ribose methyltransferase (accession YP_009725311.1)
Virus Target ID
Host Target
Host Target Id
GO Code
Cell line
In-vivo Testin silico
Outcomestrong binding in the active site of 2'OMTase
Molecular Weight586.69
IC50 (in uM)
EC50 (in uM)
Kd(in nM)
H-bond Acceptor6
H-bond Donor1
No. of Rotatable Bond Count5
XLogP2.78
PSA112.5
Bio Availabilitytrue
Lead Likenessfalse
New Inhibitor (NR) / Repurposed Drug (RD)Repurposing
Reference(s)https://chemrxiv.org/articles/Computational_Guided_Drug_Repurposing_for_Targeting_2_-O-Ribose_Methyltransferase_of_SARS-CoV-2/12111138/1
DOI https://doi.org/10.26434/chemrxiv.12111138.v1
Curator NameAnkita
Curatorshukla.ankita39@gmail.com


Record - 6 of 8   [TOP]
Inhibitor IDSARSCOV2-0286
Inhibitor NameTeniposide
FormulaC32H32O13S
SMILES[H][C@]12COC(=O)[C@]1([H])[C@H](C1=CC(OC)=C(O)C(OC)=C1)C1=C(C=C3OCOC3=C1)[C@H]2O[C@]1([H])O[C@]2([H])CO[C@H](O[C@@]2([H])[C@H](O)[C@H]1O)C1=CC=CS1
Inhibitor Structure
DOWNLOAD:
PubChem ID 452548
Drug Bank ID DB00444 (APRD00649)
ChemSpider ID 
Virus_Target2'-O-ribose methyltransferase (accession YP_009725311.1)
Virus Target ID
Host Target
Host Target Id
GO Code
Cell line
In-vivo Testin silico
Outcomestrong binding in the active site of 2'OMTase
Molecular Weight656.66
IC50 (in uM)
EC50 (in uM)
Kd(in nM)
H-bond Acceptor12
H-bond Donor3
No. of Rotatable Bond Count6
XLogP2.78
PSA160.8
Bio Availabilityfalse
Lead Likenessfalse
New Inhibitor (NR) / Repurposed Drug (RD)Repurposing
Reference(s)https://chemrxiv.org/articles/Computational_Guided_Drug_Repurposing_for_Targeting_2_-O-Ribose_Methyltransferase_of_SARS-CoV-2/12111138/1
DOI https://doi.org/10.26434/chemrxiv.12111138.v1
Curator NameAnkita
Curatorshukla.ankita39@gmail.com


Record - 7 of 8   [TOP]
Inhibitor IDSARSCOV2-0299
Inhibitor NameTriamcinolone acetonide
FormulaC21H27FO6
SMILES[H][C@@]12C[C@@H](O)[C@](O)(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]1(F)[C@@]2([H])CCC2=CC(=O)C=C[C@]12C
Inhibitor Structure
DOWNLOAD:
PubChem ID 6436
Drug Bank ID DB00620 (APRD00422)
ChemSpider ID 
Virus_Target2'-O-ribose methyltransferase (accession YP_009725311.1)
Virus Target ID
Host Target
Host Target Id
GO Code
Cell line
In-vivo Testin silico
Outcomestrong binding in the active site of 2'OMTase
Molecular Weight394.44
IC50 (in uM)
EC50 (in uM)
Kd(in nM)
H-bond Acceptor6
H-bond Donor4
No. of Rotatable Bond Count2
XLogP0.24
PSA115.0
Bio Availabilitytrue
Lead Likenesstrue
New Inhibitor (NR) / Repurposed Drug (RD)Repurposing
Reference(s)https://chemrxiv.org/articles/Computational_Guided_Drug_Repurposing_for_Targeting_2_-O-Ribose_Methyltransferase_of_SARS-CoV-2/12111138/1
DOI https://doi.org/10.26434/chemrxiv.12111138.v1
Curator NameAnkita
Curatorshukla.ankita39@gmail.com


Record - 8 of 8   [TOP]
Inhibitor IDSARSCOV2-0319
Inhibitor NameZafirlukast
FormulaC31H33N3O6S
SMILESCOC1=CC(=CC=C1CC1=CN(C)C2=C1C=C(NC(=O)OC1CCCC1)C=C2)C(=O)NS(=O)(=O)C1=CC=CC=C1C
Inhibitor Structure
DOWNLOAD:
PubChem ID 5717
Drug Bank ID DB00549 (APRD00377)
ChemSpider ID 
Virus_Target2'-O-ribose methyltransferase (accession YP_009725311.1)
Virus Target ID
Host Target
Host Target Id
GO Code
Cell line
In-vivo Testin silico
Outcomestrong binding in the active site of 2'OMTase
Molecular Weight575.68
IC50 (in uM)
EC50 (in uM)
Kd(in nM)
H-bond Acceptor6
H-bond Donor2
No. of Rotatable Bond Count8
XLogP6.40
PSA115.7
Bio Availabilityfalse
Lead Likenessfalse
New Inhibitor (NR) / Repurposed Drug (RD)Repurposing
Reference(s)https://chemrxiv.org/articles/Computational_Guided_Drug_Repurposing_for_Targeting_2_-O-Ribose_Methyltransferase_of_SARS-CoV-2/12111138/1
DOI https://doi.org/10.26434/chemrxiv.12111138.v1
Curator NameAnkita
Curatorshukla.ankita39@gmail.com