Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11257536 | 0.93 | ALDH1A1 (0.39) | ALDH1A1LMNACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL11257544 | 0.93 | ALDH1A1 (0.39) | ALDH1A1LMNACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL11261506 | 0.90 | ALDH1A1 (0.38) | ALDH1A1LMNACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL11261502 | 0.90 | ALDH1A1 (0.38) | ALDH1A1LMNACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL11253126 | 0.83 | ALDH1A1 (0.38) | ALDH1A1LMNACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL11255951 | 0.83 | ALDH1A1 (0.41) | ALDH1A1LMNACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL11254020 | 0.83 | ALDH1A1 (0.42) | ALDH1A1LMNACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL11254017 | 0.83 | ALDH1A1 (0.42) | ALDH1A1LMNACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL11267296 | 0.83 | TP53 (0.39) | ALDH1A1LMNACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL11270355 | 0.83 | TP53 (0.39) | ALDH1A1LMNACYP1A2CYP2D6CYP2C19 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4161476-A | α-Halo-2-oxo-1-azetidinemethane-carboxylic acid compounds | CIBA-GEIGY CORPORATION (US) | 1979-07-17 | — | — | US | disclosed |
| US-4052408-A | OXYACETIC ACID COMPOUNDS AND PROCESS FOR THEIR MANUFACTURE | CIBA-GEIGY CORPORATION (US) | 1977-10-04 | — | — | US | disclosed |