Tacrolimus

Basic Information


CAS ID: 104987-11-3
Molecular Formula: C44H69NO12
Molecular Weight: 804 g/mol
Monoisotopic Mass: 803.482 g/mol
Class: Small Molecule
Natural Product: No
Other Names: FR-900506 | TACNI | Prograf | MODIGRAF | FK 506 | FR900506 | FK-506 | PROGRAF | ADOPORT | TACROLIMUS HYDRATE | PROTOPIC | ADVAGRAF | Protopic | ASTAGRAF XL | VIVADEX | PERIXIS | CAPEXION | TACROLIMUS | ENVARSUS | ENVARSUS XR
Analysis: Drug repositioning mechanism analysis

O OH O O N O O OH O O OH O O


Compound Structure and Identifier


InChI: InChI=1S/C44H69NO12/c1-10-13-31-19-25(2)18-26(3)20-37(54-8)40-38(55-9)22-28(5)44(52,57-40)41(49)42(50)45-17-12-11-14-32(45)43(51)56-39(29(6)34(47)24-35(31)48)27(4)21-30-15-16-33(46)36(23-30)53-7/h10,19,21,26,28-34,36-40,46-47,52H,1,11-18,20,22-24H2,2-9H3/b25-19+,27-21+/t26-,28+,29+,30-,31+,32-,33+,34-,36+,37-,38-,39+,40+,44+/m0/s1 See All
InChI Key: QJJXYPPXXYFBGM-LFZNUXCKSA-N
Smiles: CO[C@@H]1C[C@@H](CC[C@H]1O)\C=C(/C)\[C@H]2OC(=O)[C@@H]3CCCCN3C(=O)C(=O)[C@]4(O)O[C@H]([C@H](C[C@@H](C)C\C(=C\[C@@H](CC=C)C(=O)C[C@H](O)[C@H]2C)\C)OC)[C@H](C[C@H]4C)OC See All
Molfile: Download


Related Target


Target ID Name Interaction
T1022 Calcineurin inhibitor

Related Fibrosis Property


Reference Record 1

PubMed ID 28669722 Target ID
Uniprot ID Name
Model vitro,rat Fibrosis Disease Epidural fibrosis
Process I
Process II fibroblasts apoptosis
Process III prevenet collagen deposition
Mechanism Targeting miR-429

Reference Record 2

PubMed ID 26905810 Target ID
Uniprot ID Name
Model rat Fibrosis Disease Renal fibrosis
Process I
Process II
Process III prevenet collagen deposition
Mechanism

Reference Record 3

PubMed ID 25953736 Target ID
Uniprot ID Name
Model human Fibrosis Disease Cystic fibrosis
Process I
Process II
Process III
Mechanism

Reference Record 4

PubMed ID 25769064 Target ID
Uniprot ID Name
Model vitro,mice Fibrosis Disease Fibrosis
Process I
Process II
Process III prevenet collagen deposition
Mechanism

Reference Record 5

PubMed ID 15808577 Target ID
Uniprot ID Name
Model rat Fibrosis Disease Renal fibrosis
Process I
Process II
Process III prevenet collagen deposition
Mechanism

Reference Record 6

PubMed ID 29371918 Target ID T1022
Uniprot ID Calcineurin Name Calcineurin
Model vitro,mice Fibrosis Disease Liver fibrosis
Process I
Process II
Process III prevenet collagen deposition
Mechanism

Trial Record 1

ClinicalTrial ID NCT02096107 Disease Renal fibrosis
Phase Phase 4 Status Completed
First Received March 26, 2014 Last Verified August 8, 2018
Sponsor Medical University of South Carolina

Trial Record 2

ClinicalTrial ID NCT00260208 Disease Liver fibrosis
Phase Phase 4 Status Terminated
First Received December 1, 2005 Last Verified December 6, 2011
Sponsor Novartis Pharmaceuticals

Trial Record 3

ClinicalTrial ID NCT01707849 Disease Liver fibrosis
Phase Phase 3 Status Completed
First Received October 16, 2012 Last Verified February 7, 2018
Sponsor Hospital Vall d'Hebron

Trial Record 4

ClinicalTrial ID NCT00538265 Disease Liver fibrosis
Phase Phase 4 Status Completed
First Received October 2, 2007 Last Verified February 3, 2011
Sponsor University Hospital, Toulouse

Trial Record 5

ClinicalTrial ID NCT03192657 Disease Pulmonary fibrosis
Phase Phase 2 Status Not yet recruiting
First Received June 20, 2017 Last Verified June 20, 2017
Sponsor RenJi Hospital

Trial Record 6

ClinicalTrial ID NCT02154854 Disease Vascular fibrosis
Phase Phase 4 Status Unknown
First Received June 3, 2014 Last Verified June 3, 2014
Sponsor University Hospital, Tours

Trial Record 7

ClinicalTrial ID NCT01860183 Disease Renal fibrosis
Phase Phase 4 Status Unknown
First Received May 22, 2013 Last Verified January 30, 2014
Sponsor Clinical Hospital Merkur

Trial Record 8

ClinicalTrial ID NCT00896012 Disease Renal fibrosis
Phase Phase 4 Status Unknown
First Received May 11, 2009 Last Verified May 11, 2009
Sponsor University at Buffalo

Trial Record 9

ClinicalTrial ID NCT00975663 Disease Cystic fibrosis
Phase Phase 4 Status Terminated
First Received September 11, 2009 Last Verified April 26, 2011
Sponsor University Hospital, Limoges

Trial Record 10

ClinicalTrial ID NCT00637143 Disease Renal fibrosis
Phase Phase 4 Status Completed
First Received March 17, 2008 Last Verified February 16, 2017
Sponsor Astellas Pharma Inc

Trial Record 11

ClinicalTrial ID NCT01150097 Disease Liver fibrosis
Phase Phase 3 Status Completed
First Received June 24, 2010 Last Verified November 7, 2018
Sponsor Novartis Pharmaceuticals

Trial Record 12

ClinicalTrial ID NCT00622869 Disease Liver fibrosis
Phase Phase 3 Status Completed
First Received February 25, 2008 Last Verified May 27, 2013
Sponsor Novartis Pharmaceuticals

Related Link


PubChem: 445643
ChEMBL: CHEMBL269732