Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 11/20 | 0.64 |
| ▸ | AKR1C2 | P52895 | 11/20 | 0.64 |
| ▸ | NPC1 | O15118 | 2/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.57 |
| ▸ | GFER | P55789 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | EGFR | P00533 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | NGLY1 | Q96IV0 | 1/20 | 0.47 |
| ▸ | FBP1 | P09467 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | XDH | P47989 | 1/20 | 0.47 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.47 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL936023 | 0.92 | AKR1C3 (0.69) | AKR1C3AKR1C2NPC1SMN1; SMN2MAPT | |
| SCHEMBL9409087 | 0.90 | AKR1C3 (0.61) | AKR1C3AKR1C2NPC1SMN1; SMN2MAPT | |
| SCHEMBL11647944 | 0.87 | MAPT (0.65) | AKR1C3AKR1C2NPC1SMN1; SMN2MAPT | |
| SCHEMBL8834179 | 0.86 | AKR1C3 (0.53) | AKR1C3AKR1C2NPC1SMN1; SMN2MAPT | |
| SCHEMBL9592992 | 0.85 | AKR1C3 (0.72) | AKR1C3AKR1C2NPC1SMN1; SMN2MAPT | |
| SCHEMBL9593414 | 0.85 | AKR1C3 (0.74) | AKR1C3AKR1C2NPC1SMN1; SMN2MAPT | |
| SCHEMBL8976069 | 0.84 | AKR1C3 (0.72) | AKR1C3AKR1C2NPC1SMN1; SMN2MAPT | |
| SCHEMBL4254887 | 0.83 | AKR1C3 (0.65) | AKR1C3AKR1C2NPC1SMN1; SMN2MAPT | |
| SCHEMBL9409101 | 0.83 | MAPT (0.54) | AKR1C3AKR1C2NPC1SMN1; SMN2MAPT | |
| SCHEMBL14598926 | 0.82 | AKR1C3 (0.81) | AKR1C3AKR1C2NPC1SMN1; SMN2MAPT |
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 |