Niacin

Niacin

SCHEMBL29396199

O=C(O)c1cccnc1.O=C(O)c1cccnc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 1.00
▸ HCAR2 Q8TDS4 2/20 1.00
▸ APP P05067 1/20 1.00
▸ GAA P10253 1/20 1.00
▸ HCAR3 P49019 1/20 1.00
▸ F7 P08709 1/20 0.65
▸ F3 P13726 1/20 0.65
▸ SARM1 Q6SZW1 1/20 0.65
▸ SIRT2 Q8IXJ6 1/20 0.65
▸ SIRT6 Q8N6T7 1/20 0.65
▸ SIRT1 Q96EB6 1/20 0.65
▸ SIRT3 Q9NTG7 1/20 0.65
▸ SIRT5 Q9NXA8 1/20 0.65
▸ SIRT4 Q9Y6E7 1/20 0.65
▸ KMO O15229 1/20 0.63
▸ PLOD2 O00469 1/20 0.62
▸ MKNK1 Q9BUB5 1/20 0.62
▸ MKNK2 Q9HBH9 1/20 0.62
▸ HDAC1 Q13547 1/20 0.61
▸ HDAC6 Q9UBN7 1/20 0.61

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Niacin SCHEMBL150011 1.00 ALDH1A1 (1.00) ALDH1A1HCAR2APPGAAHCAR3
Niacin SCHEMBL29349574 1.00 — —
Niacin SCHEMBL28292236 1.00 ALDH1A1 (1.00) ALDH1A1HCAR2APPGAAHCAR3
Niacin SCHEMBL30844065 1.00 — —
Niacin SCHEMBL3081560 1.00 ALDH1A1 (1.00) ALDH1A1HCAR2APPGAAHCAR3
Niacin SCHEMBL1433 1.00 — —
Niacin SCHEMBL23780926 0.98 ALDH1A1 (0.95) ALDH1A1HCAR2APPGAAHCAR3
Niacin SCHEMBL25235888 0.98 ALDH1A1 (0.95) ALDH1A1HCAR2APPGAAHCAR3
Niacin SCHEMBL25247085 0.98 ALDH1A1 (0.95) ALDH1A1HCAR2APPGAAHCAR3
Niacin SCHEMBL23780927 0.98 ALDH1A1 (0.95) ALDH1A1HCAR2APPGAAHCAR3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4559902-A2 KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE Imago Biosciences Inc. (US) 2025-05-28 — — EP disclosed
EP-3256218-B1 A KDM1A INHIBITOR AND ITS USE IN THERAPY IMAGO BIOSCIENCES INC (US) 2024-12-11 — — EP disclosed
CN-118973577-A Apostistin for the treatment of multiple system atrophy 施万生物制药研发IP有限责任公司 2024-11-15 — — CN disclosed
CN-118613596-A Biomarkers for detecting and distinguishing invasive prostate cancer from inert forms and treatment of invasive prostate cancer 约翰霍普金斯大学 2024-09-06 — — CN disclosed
CN-111655859-B Microorganism for producing putrescine and method for producing putrescine using the same CJ第一制糖株式会社 2024-09-03 — — CN disclosed
CN-114569633-B Intestinal selective chelators for the treatment and prevention of autism and related disorders 轴向治疗公司 2023-11-17 — — CN disclosed
CN-111225672-B Mevalonate pathway inhibitor and pharmaceutical composition thereof 清华大学 2023-09-29 — — CN disclosed
CN-115813923-A Compounds for the treatment of neurogenic orthostatic hypotension 施万生物制药研发IP有限责任公司 2023-03-21 — — CN disclosed
CN-115770244-A Compounds for the treatment of neurogenic orthostatic hypotension 施万生物制药研发IP有限责任公司 2023-03-10 — — CN disclosed
CN-114746092-A D-amphetamine compounds, compositions, and methods of making and using the same 肯法姆股份有限公司 2022-07-12 — — CN disclosed
CN-114746091-A D-amphetamine compounds, compositions, and methods of making and using the same 肯法姆股份有限公司 2022-07-12 — — CN disclosed
CN-114569633-A Gut-selective chelating agents for the treatment and prevention of autism and related disorders 轴向治疗公司 2022-06-03 — — CN disclosed
CN-110944650-B Gut-selective chelating agents for the treatment and prevention of autism and related disorders 轴向治疗公司 2022-03-04 — — CN disclosed
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