Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | CES2 | O00748 | 8/20 | 0.45 |
| ▸ | CES1 | P23141 | 7/20 | 0.45 |
| ▸ | AKT1 | P31749 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | XBP1 | P17861 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9099207 | 0.76 | ALDH1A1 (0.50) | EGFRRAB9ACES2CES1LMNA | |
| SCHEMBL815584 | 0.76 | ALDH1A1 (0.50) | EGFRRAB9ACES2CES1LMNA | |
| SCHEMBL20025642 | 0.76 | CES2 (0.54) | EGFRRAB9ACES2CES1AKT1 | |
| SCHEMBL10418219 | 0.74 | RAB9A (0.39) | EGFRRAB9ACES2CES1LMNA | |
| SCHEMBL27693488 | 0.73 | ALDH1A1 (0.43) | EGFRAKT1LMNAMAPTRECQL | |
| SCHEMBL25527318 | 0.72 | LMNA (0.30) | LMNA | |
| SCHEMBL18413421 | 0.72 | AKT1 (0.52) | EGFRRAB9ACES2CES1AKT1 | |
| Benzil SCHEMBL27704217 | 0.72 | CES2 (0.56) | EGFRRAB9ACES2CES1AKT1 | |
| SCHEMBL23222456 | 0.71 | CES2 (0.45) | EGFRRAB9ACES2CES1AKT1 | |
| SCHEMBL23934158 | 0.71 | MEN1 (0.46) | EGFRRAB9ACES2CES1AKT1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000052100-A1 | AGENTS FOR COLOURING FIBRES | WELLA AKTIENGESELLSCHAFT (DE) | 2000-09-08 | — | — | WO | disclosed |