Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | RAD52 | P43351 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.40 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.39 |
| ▸ | KDR | P35968 | 2/20 | 0.39 |
| ▸ | ATR | Q13535 | 1/20 | 0.39 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.39 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL24900401 | 0.93 | ROCK2 (0.52) | ROCK2CYP1A2CYP2C19CYP2C9ALDH1A1 | |
| SCHEMBL11262757 | 0.85 | CYP1A2 (0.46) | CYP1A2CYP2C19CYP2C9ALDH1A1SMN1; SMN2 | |
| SCHEMBL16188464 | 0.84 | CYP1A2 (0.40) | CYP1A2CYP2C19CYP2D6ALDH1A1SMN1; SMN2 | |
| SCHEMBL11267590 | 0.83 | CYP1A2 (0.47) | CYP1A2CYP2C19CYP2C9ALDH1A1SMN1; SMN2 | |
| SCHEMBL11647393 | 0.83 | CYP1A2 (0.47) | ROCK2CYP1A2CYP2C19CYP2C9ALDH1A1 | |
| SCHEMBL3124309 | 0.82 | KDM4E (0.51) | CYP1A2CYP2C19CYP2C9ALDH1A1SMN1; SMN2 | |
| SCHEMBL5256278 | 0.80 | CYP1A2 (0.63) | CYP1A2CYP2C19CYP2C9ALDH1A1SMN1; SMN2 | |
| SCHEMBL11233515 | 0.80 | RAB9A (0.52) | ALDH1A1SMN1; SMN2LMNAKDM4E | |
| SCHEMBL16096566 | 0.79 | EGFR (0.48) | BCHEACHENR4A2KDR | |
| SCHEMBL6575856 | 0.77 | KCNH2 (0.56) | CYP1A2CYP2C19CYP2C9CYP2D6ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4330292-A | CONTAINING AN OXIDATION BASE | L'OREAL (FR) | 1982-05-18 | — | — | US | disclosed |