Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 8/20 | 0.55 |
| ▸ | AKR1C2 | P52895 | 8/20 | 0.55 |
| ▸ | SIRT2 | Q8IXJ6 | 7/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | GAA | P10253 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | GFER | P55789 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9409210 | 0.89 | SIRT2 (0.58) | AKR1C3AKR1C2SIRT2KDM4EGAA | |
| SCHEMBL2723037 | 0.83 | SIRT2 (0.58) | SIRT2KDM4EGAAMAPTGFER | |
| SCHEMBL22725391 | 0.83 | AKR1C3 (0.70) | AKR1C3AKR1C2KDM4EGAAMAPT | |
| SCHEMBL9409097 | 0.82 | MAPT (0.57) | AKR1C3AKR1C2SIRT2KDM4EGAA | |
| SCHEMBL11177202 | 0.82 | AKR1C3 (0.57) | AKR1C3AKR1C2SIRT2KDM4EGAA | |
| SCHEMBL9409036 | 0.81 | PRKD3 (0.51) | SIRT2KDM4EGAAMAPTGFER | |
| SCHEMBL9409084 | 0.81 | SIRT2 (0.73) | AKR1C3AKR1C2SIRT2KDM4EGAA | |
| SCHEMBL9409032 | 0.81 | SIRT2 (0.59) | AKR1C3AKR1C2SIRT2 | |
| SCHEMBL2391240 | 0.80 | MEN1 (0.50) | SIRT2MAPTALDH1A1MEN1KMT2A | |
| SCHEMBL9409101 | 0.80 | MAPT (0.54) | AKR1C3AKR1C2SIRT2KDM4EGAA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0600832-A1 | Derivatives of diamino benzoic and diamino phthalic acid und their use as protein linase inhibitors | CIBA-GEIGY AG (CH) | 1994-06-08 | — | — | EP | disclosed |