Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.57 |
| ▸ | NPC1 | O15118 | 2/20 | 0.57 |
| ▸ | RAB9A | P51151 | 2/20 | 0.57 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.57 |
| ▸ | RELA | Q04206 | 1/20 | 0.57 |
| ▸ | STING1 | Q86WV6 | 1/20 | 0.56 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 7/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.54 |
| ▸ | MAPT | P10636 | 6/20 | 0.54 |
| ▸ | LMNA | P02545 | 4/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | THPO | P40225 | 1/20 | 0.54 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL31278033 | 0.96 | P4HTM (0.54) | SMN1; SMN2ALDH1A1NFKB1NPC1RAB9A | |
| SCHEMBL31277872 | 0.84 | NPC1 (0.63) | SMN1; SMN2ALDH1A1NFKB1NPC1RAB9A | |
| SCHEMBL31277665 | 0.84 | NPC1 (0.63) | SMN1; SMN2ALDH1A1NFKB1NPC1RAB9A | |
| SCHEMBL31277479 | 0.83 | ALDH1A1 (0.62) | SMN1; SMN2ALDH1A1NFKB1NPC1RAB9A | |
| SCHEMBL10803370 | 0.83 | ABCG2 (0.68) | SMN1; SMN2ALDH1A1NPC1RAB9ASTING1 | |
| Hydrochloric Acid SCHEMBL31277678 | 0.82 | MAPT (0.55) | SMN1; SMN2ALDH1A1NFKB1NPC1RAB9A | |
| SCHEMBL11037431 | 0.81 | KDM4E (0.66) | SMN1; SMN2ALDH1A1NFKB1NPC1RAB9A | |
| SCHEMBL22232689 | 0.80 | P4HTM (0.70) | SMN1; SMN2NPC1RAB9AP4HTMMEN1 | |
| SCHEMBL31277333 | 0.80 | MAPT (0.50) | SMN1; SMN2ALDH1A1NFKB1NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL31277294 | 0.79 | NPC1 (0.57) | SMN1; SMN2ALDH1A1NFKB1NPC1RAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024246946-A1 | NOVEL PYRIDINE CARBOXAMIDE COMPOUNDS WITH ANTI-TUBERCULAR ACTIVITY | TRANSLATIONAL HEALTH SCIENCE AND TECHNOLOGY INSTITUTE (IN) | 2024-12-05 | — | — | WO | claimed |
| WO-2024246946-A1 | NOVEL PYRIDINE CARBOXAMIDE COMPOUNDS WITH ANTI-TUBERCULAR ACTIVITY | TRANSLATIONAL HEALTH SCIENCE AND TECHNOLOGY INSTITUTE (IN) | 2024-12-05 | — | — | WO | disclosed |