Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | POLB | P06746 | 4/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.58 |
| ▸ | GLA | P06280 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.58 |
| ▸ | HPGD | P15428 | 1/20 | 0.58 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.58 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.58 |
| ▸ | APEX1 | P27695 | 1/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.53 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | TNF | P01375 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 2/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL512529 | 0.86 | ALDH1A1 (0.71) | ALDH1A1POLBKDM4ETP53GLA | |
| SCHEMBL7288420 | 0.86 | ALDH1A1 (0.71) | ALDH1A1POLBKDM4ETP53GLA | |
| SCHEMBL6694333 | 0.83 | ALDH1A1 (0.69) | ALDH1A1POLBKDM4ETP53GLA | |
| SCHEMBL9899442 | 0.81 | ALDH1A1 (0.55) | ALDH1A1POLBKDM4ETP53GLA | |
| SCHEMBL12942067 | 0.79 | ALDH1A1 (0.56) | ALDH1A1POLBKDM4ETP53GLA | |
| SCHEMBL9160856 | 0.78 | TP53 (0.59) | ALDH1A1POLBKDM4ETP53GLA | |
| SCHEMBL74043 | 0.78 | ALDH1A1 (0.51) | ALDH1A1POLBKDM4ETP53GLA | |
| SCHEMBL11203228 | 0.77 | ALDH1A1 (0.56) | ALDH1A1POLBKDM4ETP53GLA | |
| SCHEMBL74356 | 0.77 | ALDH1A1 (0.50) | ALDH1A1POLBKDM4ETP53GLA | |
| SCHEMBL74882 | 0.77 | ALDH1A1 (0.50) | ALDH1A1POLBKDM4ETP53GLA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0595610-B1 | Benzo-fused lactams | SQUIBB & SONS INC (US) | 1997-05-07 | — | — | EP | disclosed |
| US-5504080-A | Benzo-fused lactams | BRISTOL-MYERS SQUIBB CO. (US) | 1996-04-02 | — | — | US | disclosed |
| EP-0595610-A1 | Benzo-fused lactams | E.R. SQUIBB & SONS, INC. (US) | 1994-05-04 | — | — | EP | disclosed |