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Chemistry

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Also known as: Mbx-8025 lysine, Seladelpar lysine dihydrate, Mbx-8025 lysine dihydrate, 928821-40-3, Seladelpar lysine [usan], Mbx-8025 lysine salt, dihydrate
Molecular Formula
C27H41F3N2O9S
Molecular Weight
626.7  g/mol
InChI Key
WTKSWPYGZDCUNQ-JZXFCXSPSA-N
FDA UNII
N1429130KR

Seladelpar Lysine
1 2D Structure

Seladelpar Lysine

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(2S)-2,6-diaminohexanoic acid;2-[4-[(2R)-2-ethoxy-3-[4-(trifluoromethyl)phenoxy]propyl]sulfanyl-2-methylphenoxy]acetic acid;dihydrate
2.1.2 InChI
InChI=1S/C21H23F3O5S.C6H14N2O2.2H2O/c1-3-27-17(11-28-16-6-4-15(5-7-16)21(22,23)24)13-30-18-8-9-19(14(2)10-18)29-12-20(25)26;7-4-2-1-3-5(8)6(9)10;;/h4-10,17H,3,11-13H2,1-2H3,(H,25,26);5H,1-4,7-8H2,(H,9,10);2*1H2/t17-;5-;;/m10../s1
2.1.3 InChI Key
WTKSWPYGZDCUNQ-JZXFCXSPSA-N
2.1.4 Canonical SMILES
CCOC(COC1=CC=C(C=C1)C(F)(F)F)CSC2=CC(=C(C=C2)OCC(=O)O)C.C(CCN)CC(C(=O)O)N.O.O
2.1.5 Isomeric SMILES
CCO[C@H](COC1=CC=C(C=C1)C(F)(F)F)CSC2=CC(=C(C=C2)OCC(=O)O)C.C(CCN)C[C@@H](C(=O)O)N.O.O
2.2 Other Identifiers
2.2.1 UNII
N1429130KR
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. Mbx-8025 Lysine

2. Seladelpar Lysine Dihydrate

3. Mbx-8025 Lysine Dihydrate

4. 928821-40-3

5. Seladelpar Lysine [usan]

6. Mbx-8025 Lysine Salt, Dihydrate

7. N1429130kr

8. Seladelpar (lysine Dihydrate)

9. Unii-n1429130kr

10. Seladelpar Lysine (usan)

11. Chembl3989960

12. Wtkswpygzdcunq-jzxfcxspsa-n

13. Hy-19522c

14. Akos040747473

15. Cs-1068545

16. D11257

17. Q27284370

18. (2s)-2,6-diaminohexanoic Acid;2-[4-[(2r)-2-ethoxy-3-[4-(trifluoromethyl)phenoxy]propyl]sulfanyl-2-methylphenoxy]acetic Acid;dihydrate

19. (r)-2-(4-((2-ethoxy-3-(4-(trifluoromethyl)phenoxy)propyl)thio)-2-methylphenoxy)acetic Acid Compound With (s)-2,6-diaminohexanoic Acid Dihydrate

20. L-lysine (4-(((2r)-2-ethoxy-3-(4-(trifluoromethyl)phenoxy)propyl)sulfanyl)-2-methylphenoxy)acetate Dihydrate

21. L-lysine, 2-(4-(((2r)-2-ethoxy-3-(4-(trifluoromethyl)phenoxy)propyl)thio)-2-methylphenoxy)acetate, Hydrate (1:1:2)

2.3.2 Other Synonyms

1. 851528-79-5

2. Mbx-8025

3. Mbx-8025 (seladelpar)

4. Seladelpar

2.4 Create Date
2015-06-01
3 Chemical and Physical Properties
Molecular Weight 626.7 g/mol
Molecular Formula C27H41F3N2O9S
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count15
Rotatable Bond Count16
Exact Mass g/mol
Monoisotopic Mass g/mol
Topological Polar Surface Area182
Heavy Atom Count42
Formal Charge0
Complexity617
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count4

Drugs in Development

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Details:

The partnership aims for the distribution of a novel selective, first-in-class, PPAR delta agonist, Livdelzi (seladelpar), to treat adults with primary biliary cholangitis (PBC).


Lead Product(s): Seladelpar Lysine

Therapeutic Area: Hepatology (Liver, Pancreatic, Gall Bladder) Brand Name: Livdelzi

Study Phase: ApprovedProduct Type: Small molecule

Sponsor: Gilead Sciences

Deal Size: Undisclosed Upfront Cash: Undisclosed

Deal Type: Partnership August 16, 2024

blank

01

Medlab Asia & Asia Health
Not Confirmed
Medlab Asia & Asia Health
Not Confirmed

Details : The partnership aims for the distribution of a novel selective, first-in-class, PPAR delta agonist, Livdelzi (seladelpar), to treat adults with primary biliary cholangitis (PBC).

Brand Name : Livdelzi

Molecule Type : Small molecule

Upfront Cash : Undisclosed

August 16, 2024

blank

Details:

Livdelzi (seladelpar) is a novel selective, first-in-class, PPAR delta agonist, indicated to treat adults with primary biliary cholangitis (PBC).


Lead Product(s): Seladelpar Lysine,Ursodeoxycholic Acid

Therapeutic Area: Hepatology (Liver, Pancreatic, Gall Bladder) Brand Name: Livdelzi

Study Phase: ApprovedProduct Type: Small molecule

Sponsor: Not Applicable

Deal Size: Not Applicable Upfront Cash: Not Applicable

Deal Type: Not Applicable August 15, 2024

blank

02

Medlab Asia & Asia Health
Not Confirmed
Medlab Asia & Asia Health
Not Confirmed

Details : Livdelzi (seladelpar) is a novel selective, first-in-class, PPAR delta agonist, indicated to treat adults with primary biliary cholangitis (PBC).

Brand Name : Livdelzi

Molecule Type : Small molecule

Upfront Cash : Not Applicable

August 15, 2024

blank

Details:

Gilead will buy out Johnson & Johnson’s global royalties for primary biliary cholangitis drug Livdelzi (seladelpar lysine), a peroxisome proliferator-activated receptor (PPAR)-delta agonist.


Lead Product(s): Seladelpar Lysine,Ursodeoxycholic Acid

Therapeutic Area: Hepatology (Liver, Pancreatic, Gall Bladder) Brand Name: Livdelzi

Study Phase: ApprovedProduct Type: Small molecule

Sponsor: Gilead

Deal Size: $320.0 million Upfront Cash: Undisclosed

Deal Type: Licensing Agreement August 08, 2024

blank

03

Medlab Asia & Asia Health
Not Confirmed
Medlab Asia & Asia Health
Not Confirmed

Details : Gilead will buy out Johnson & Johnson’s global royalties for primary biliary cholangitis drug Livdelzi (seladelpar lysine), a peroxisome proliferator-activated receptor (PPAR)-delta agonist.

Brand Name : Livdelzi

Molecule Type : Small molecule

Upfront Cash : Undisclosed

August 08, 2024

blank

Details:

MBX-8025 (seladelpar) is an investigational first-in-class oral, selective PPAR delta agonist which is being evaluated for the treatment of Primary Biliary Cholangitis.


Lead Product(s): Seladelpar Lysine

Therapeutic Area: Hepatology (Liver, Pancreatic, Gall Bladder) Brand Name: MBX-8025

Study Phase: Phase IIIProduct Type: Small molecule

Sponsor: Not Applicable

Deal Size: Not Applicable Upfront Cash: Not Applicable

Deal Type: Not Applicable June 05, 2024

blank

04

Medlab Asia & Asia Health
Not Confirmed
Medlab Asia & Asia Health
Not Confirmed

Details : MBX-8025 (seladelpar) is an investigational first-in-class oral, selective PPAR delta agonist which is being evaluated for the treatment of Primary Biliary Cholangitis.

Brand Name : MBX-8025

Molecule Type : Small molecule

Upfront Cash : Not Applicable

June 05, 2024

blank

Details:

MBX-8025 (seladelpar) is a first-in-class oral, selective peroxisome proliferator-activated receptor delta agonist being evaluated for treating primary biliary cholangitis.


Lead Product(s): Seladelpar Lysine

Therapeutic Area: Hepatology (Liver, Pancreatic, Gall Bladder) Brand Name: MBX-8025

Study Phase: Phase IIIProduct Type: Small molecule

Sponsor: Not Applicable

Deal Size: Not Applicable Upfront Cash: Not Applicable

Deal Type: Not Applicable May 18, 2024

blank

05

Medlab Asia & Asia Health
Not Confirmed
Medlab Asia & Asia Health
Not Confirmed

Details : MBX-8025 (seladelpar) is a first-in-class oral, selective peroxisome proliferator-activated receptor delta agonist being evaluated for treating primary biliary cholangitis.

Brand Name : MBX-8025

Molecule Type : Small molecule

Upfront Cash : Not Applicable

May 18, 2024

blank

Details:

Gilead expands its liver portfolio by acquiring CymaBay’s MBX-8025 (seladelpar), a PPARδ agonist for treating primary biliary cholangitis (PBC) and associated pruritus.


Lead Product(s): Seladelpar Lysine

Therapeutic Area: Hepatology (Liver, Pancreatic, Gall Bladder) Brand Name: MBX-8025

Study Phase: Phase IIIProduct Type: Small molecule

Sponsor: Gilead Sciences

Deal Size: $4,300.0 million Upfront Cash: $4,300.0 million

Deal Type: Acquisition March 22, 2024

blank

06

Medlab Asia & Asia Health
Not Confirmed
Medlab Asia & Asia Health
Not Confirmed

Details : Gilead expands its liver portfolio by acquiring CymaBay’s MBX-8025 (seladelpar), a PPARδ agonist for treating primary biliary cholangitis (PBC) and associated pruritus.

Brand Name : MBX-8025

Molecule Type : Small molecule

Upfront Cash : $4,300.0 million

March 22, 2024

blank

Details:

MBX-8025 (seladelpar) is an investigational first-in-class oral, selective peroxisome proliferator-activated receptor delta (PPARδ) agonist which is being evaluated for Primary Biliary Cholangitis.


Lead Product(s): Seladelpar Lysine

Therapeutic Area: Hepatology (Liver, Pancreatic, Gall Bladder) Brand Name: MBX-8025

Study Phase: Phase IIIProduct Type: Small molecule

Sponsor: Not Applicable

Deal Size: Not Applicable Upfront Cash: Not Applicable

Deal Type: Not Applicable March 04, 2024

blank

07

Medlab Asia & Asia Health
Not Confirmed
Medlab Asia & Asia Health
Not Confirmed

Details : MBX-8025 (seladelpar) is an investigational first-in-class oral, selective peroxisome proliferator-activated receptor delta (PPARδ) agonist which is being evaluated for Primary Biliary Cholangitis.

Brand Name : MBX-8025

Molecule Type : Small molecule

Upfront Cash : Not Applicable

March 04, 2024

blank

Details:

Gilead expands its liver portfolio with CymaBay’s MBX-8025 (seladelpar), a PPARδ agonist for primary biliary cholangitis.


Lead Product(s): Seladelpar Lysine

Therapeutic Area: Hepatology (Liver, Pancreatic, Gall Bladder) Brand Name: MBX-8025

Study Phase: Phase IIIProduct Type: Small molecule

Sponsor: Gilead Sciences

Deal Size: $4,300.0 million Upfront Cash: $4,300.0 million

Deal Type: Acquisition February 12, 2024

blank

08

Medlab Asia & Asia Health
Not Confirmed
Medlab Asia & Asia Health
Not Confirmed

Details : Gilead expands its liver portfolio with CymaBay’s MBX-8025 (seladelpar), a PPARδ agonist for primary biliary cholangitis.

Brand Name : MBX-8025

Molecule Type : Small molecule

Upfront Cash : $4,300.0 million

February 12, 2024

blank

Details:

MBX-8025 (seladelpar) is an investigational first-in-class oral, selective peroxisome proliferator-activated receptor delta (PPARδ) agonist which is being evaluated for Primary Biliary Cholangitis.


Lead Product(s): Seladelpar Lysine

Therapeutic Area: Hepatology (Liver, Pancreatic, Gall Bladder) Brand Name: MBX-8025

Study Phase: Phase IIIProduct Type: Small molecule

Sponsor: Not Applicable

Deal Size: Not Applicable Upfront Cash: Not Applicable

Deal Type: Not Applicable February 12, 2024

blank

09

Medlab Asia & Asia Health
Not Confirmed
Medlab Asia & Asia Health
Not Confirmed

Details : MBX-8025 (seladelpar) is an investigational first-in-class oral, selective peroxisome proliferator-activated receptor delta (PPARδ) agonist which is being evaluated for Primary Biliary Cholangitis.

Brand Name : MBX-8025

Molecule Type : Small molecule

Upfront Cash : Not Applicable

February 12, 2024

blank

Details:

MBX-8025 (seladelpar) is an investigational treatment for people with PBC, is a first-in-class oral, selective peroxisome proliferator-activated receptor delta (PPARδ) agonist which is being evaluated for the treatment of Primary Biliary Cholangitis.


Lead Product(s): Seladelpar Lysine

Therapeutic Area: Hepatology (Liver, Pancreatic, Gall Bladder) Brand Name: MBX-8025

Study Phase: Phase IIIProduct Type: Small molecule

Sponsor: Not Applicable

Deal Size: Not Applicable Upfront Cash: Not Applicable

Deal Type: Not Applicable December 15, 2023

blank

10

Medlab Asia & Asia Health
Not Confirmed
Medlab Asia & Asia Health
Not Confirmed

Details : MBX-8025 (seladelpar) is an investigational treatment for people with PBC, is a first-in-class oral, selective peroxisome proliferator-activated receptor delta (PPARδ) agonist which is being evaluated for the treatment of Primary Biliary Cholangitis.

Brand Name : MBX-8025

Molecule Type : Small molecule

Upfront Cash : Not Applicable

December 15, 2023

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