Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRSS1 | P07477 | 1/20 | 0.45 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.45 |
| ▸ | CACNA1H | O95180 | 4/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CDC42 | P60953 | 1/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.37 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | F13A1 | P00488 | 1/20 | 0.37 |
| ▸ | TGM2 | P21980 | 1/20 | 0.37 |
| ▸ | TGM1 | P22735 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7336752 | 0.76 | SHMT2 (0.51) | PRSS1TPSAB1CACNA1HHDAC1L3MBTL1 | |
| SCHEMBL8426730 | 0.74 | PRSS1 (0.56) | PRSS1TPSAB1CACNA1HABCB1L3MBTL1 | |
| SCHEMBL855297 | 0.73 | HDAC1 (0.47) | PRSS1TPSAB1CACNA1HHDAC1NPC1 | |
| SCHEMBL29940493 | 0.72 | PRSS1 (0.41) | PRSS1TPSAB1CACNA1HHDAC1NPC1 | |
| SCHEMBL29302722 | 0.72 | PRSS1 (0.41) | PRSS1TPSAB1CACNA1HHDAC1NPC1 | |
| SCHEMBL11517533 | 0.71 | PRSS1 (0.60) | PRSS1TPSAB1CACNA1HABCB1RAB9A | |
| SCHEMBL8571304 | 0.71 | PRSS1 (0.63) | PRSS1TPSAB1CACNA1HHDAC1ABCB1 | |
| SCHEMBL5331588 | 0.71 | ALDH1A1 (0.51) | PRSS1TPSAB1ABCB1L3MBTL1F13A1 | |
| SCHEMBL8241799 | 0.70 | CACNA1H (0.56) | PRSS1TPSAB1CACNA1HABCB1F13A1 | |
| SCHEMBL7505433 | 0.70 | PRSS1 (0.59) | PRSS1TPSAB1CACNA1HABCB1F13A1 |
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-2023250157-A9 | INHIBITORS OF MYCOBACTERIUM TUBERCULOSIS LIPOAMIDE DEHYDROGENASE | CORNELL UNIVERSITY (US) | 2024-01-25 | — | — | WO | disclosed |
| WO-2023250157-A1 | INHIBITORS OF MYCOBACTERIUM TUBERCULOSIS LIPOAMIDE DEHYDROGENASE | CORNELL UNIVERSITY (US) | 2023-12-28 | — | — | WO | disclosed |