Chemistry:BMS-986278

BMS-986278
Legal status
Legal status	Investigational;
Identifiers
	IUPAC name (1S,3S)-3-[2-Methyl-6-[1-methyl-5-[[methyl(propyl)carbamoyl]oxymethyl]triazol-4-yl]pyridin-3-yl]oxycyclohexane-1-carboxylic acid;
CAS Number	2170126-74-4;
PubChem CID	132232205;
ChemSpider	115009679;
UNII	4UN9AOU6G8;
ChEMBL	ChEMBL5087506;
Chemical and physical data
Formula	C22H31N5O5
Molar mass	445.520 g·mol−1
3D model (JSmol)	Interactive image;
	SMILES CCCN(C)C(=O)OCC1=C(N=NN1C)C2=NC(=C(C=C2)O[C@H]3CCC[C@@H](C3)C(=O)O)C;
	InChI InChI=1S/C22H31N5O5/c1-5-11-26(3)22(30)31-13-18-20(24-25-27(18)4)17-9-10-19(14(2)23-17)32-16-8-6-7-15(12-16)21(28)29/h9-10,15-16H,5-8,11-13H2,1-4H3,(H,28,29)/t15-,16-/m0/s1; Key:UEUNDURNLYLSNB-HOTGVXAUSA-N;

Short description: Chemical compound

BMS-986278 is an experimental small-molecule drug and lysophosphatidic acid receptor 1 (LPA1) antagonist developed by Bristol Myers Squibb for idiopathic pulmonary fibrosis.^[1]^[2]^[3]

References

↑ Murphy, Brian; Sum, Chi-Shing; Wang, Tao; Heiry, Rebekah; Kalinowski, Stephen; Hung, Chen-Pin; Chu, Ching-Hsuen; Azzara, Anthony et al. (28 September 2019). "LPA1 antagonist BMS-986278 for idiopathic pulmonary fibrosis: Preclinical pharmacological in vitro and in vivo evaluation". Idiopathic interstitial pneumonias. pp. PA5383. doi:10.1183/13993003.congress-2019.PA5383.
↑ Cheng, Peter T. W.; Kaltenbach, Robert F.; Zhang, Hao; Shi, Jun; Tao, Shiwei; Li, Jun; Kennedy, Lawrence J.; Walker, Steven J. et al. (11 November 2021). "Discovery of an Oxycyclohexyl Acid Lysophosphatidic Acid Receptor 1 (LPA 1 ) Antagonist BMS-986278 for the Treatment of Pulmonary Fibrotic Diseases". Journal of Medicinal Chemistry 64 (21): 15549–15581. doi:10.1021/acs.jmedchem.1c01256. PMID 34709814.
↑ Corte, Tamera J; Lancaster, Lisa; Swigris, Jeffrey J; Maher, Toby M; Goldin, Jonathan G; Palmer, Scott M; Suda, Takafumi; Ogura, Takashi et al. (December 2021). "Phase 2 trial design of BMS-986278, a lysophosphatidic acid receptor 1 (LPA 1 ) antagonist, in patients with idiopathic pulmonary fibrosis (IPF) or progressive fibrotic interstitial lung disease (PF-ILD)". BMJ Open Respiratory Research 8 (1): e001026. doi:10.1136/bmjresp-2021-001026. PMID 34969771.

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Original source: https://en.wikipedia.org/wiki/BMS-986278. Read more

[1] Murphy, Brian; Sum, Chi-Shing; Wang, Tao; Heiry, Rebekah; Kalinowski, Stephen; Hung, Chen-Pin; Chu, Ching-Hsuen; Azzara, Anthony et al. (28 September 2019). "LPA1 antagonist BMS-986278 for idiopathic pulmonary fibrosis: Preclinical pharmacological in vitro and in vivo evaluation". Idiopathic interstitial pneumonias. pp. PA5383. doi:10.1183/13993003.congress-2019.PA5383.

[2] Cheng, Peter T. W.; Kaltenbach, Robert F.; Zhang, Hao; Shi, Jun; Tao, Shiwei; Li, Jun; Kennedy, Lawrence J.; Walker, Steven J. et al. (11 November 2021). "Discovery of an Oxycyclohexyl Acid Lysophosphatidic Acid Receptor 1 (LPA 1 ) Antagonist BMS-986278 for the Treatment of Pulmonary Fibrotic Diseases". Journal of Medicinal Chemistry 64 (21): 15549–15581. doi:10.1021/acs.jmedchem.1c01256. PMID 34709814.

[3] Corte, Tamera J; Lancaster, Lisa; Swigris, Jeffrey J; Maher, Toby M; Goldin, Jonathan G; Palmer, Scott M; Suda, Takafumi; Ogura, Takashi et al. (December 2021). "Phase 2 trial design of BMS-986278, a lysophosphatidic acid receptor 1 (LPA 1 ) antagonist, in patients with idiopathic pulmonary fibrosis (IPF) or progressive fibrotic interstitial lung disease (PF-ILD)". BMJ Open Respiratory Research 8 (1): e001026. doi:10.1136/bmjresp-2021-001026. PMID 34969771.

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Legal status	Investigational
Identifiers
IUPAC name (1S,3S)-3-[2-Methyl-6-[1-methyl-5-[[methyl(propyl)carbamoyl]oxymethyl]triazol-4-yl]pyridin-3-yl]oxycyclohexane-1-carboxylic acid
CAS Number	2170126-74-4
PubChem CID	132232205
ChemSpider	115009679
UNII	4UN9AOU6G8
ChEMBL	ChEMBL5087506
Chemical and physical data
Formula	C₂₂H₃₁N₅O₅
Molar mass	445.520 g·mol⁻¹
3D model (JSmol)	Interactive image
SMILES CCCN(C)C(=O)OCC1=C(N=NN1C)C2=NC(=C(C=C2)O[C@H]3CCC[C@@H](C3)C(=O)O)C
InChI InChI=1S/C22H31N5O5/c1-5-11-26(3)22(30)31-13-18-20(24-25-27(18)4)17-9-10-19(14(2)23-17)32-16-8-6-7-15(12-16)21(28)29/h9-10,15-16H,5-8,11-13H2,1-4H3,(H,28,29)/t15-,16-/m0/s1 Key:UEUNDURNLYLSNB-HOTGVXAUSA-N

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