Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 6/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | F2 | P00734 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | VDR | P11473 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | XBP1 | P17861 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10542563 | 0.87 | ALDH1A1 (0.41) | ALDH1A1CYP1A2CYP2C9GAAMAPT | |
| SCHEMBL30660870 | 0.85 | ALDH1A1 (0.40) | ALDH1A1CYP1A2CYP2C9GAAMAPT | |
| SCHEMBL10851006 | 0.85 | ALDH1A1 (0.40) | ALDH1A1CYP1A2CYP2C9GAAMAPT | |
| SCHEMBL29885712 | 0.84 | ALDH1A1 (0.44) | ALDH1A1CYP1A2CYP2C9GAAMAPT | |
| SCHEMBL3676987 | 0.84 | ALDH1A1 (0.44) | ALDH1A1CYP1A2CYP2C9GAAMAPT | |
| SCHEMBL34465355 | 0.83 | ALDH1A1 (0.42) | ALDH1A1CYP1A2CYP2C9GAAMAPT | |
| SCHEMBL29565442 | 0.83 | ALDH1A1 (0.46) | ALDH1A1CYP1A2CYP2C9GAAMAPT | |
| SCHEMBL9425523 | 0.83 | ALDH1A1 (0.46) | ALDH1A1CYP1A2CYP2C9GAAMAPT | |
| SCHEMBL14587496 | 0.83 | CA12 (0.44) | ALDH1A1CYP1A2CYP2C9GAAKMT2A | |
| SCHEMBL9669589 | 0.81 | ALDH1A1 (0.41) | ALDH1A1CYP1A2CYP2C9GAAMAPT |
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-5438052-A | Cephalosporin derivatives | HOFFMANN-LA ROCHE INC. (US) | 1995-08-01 | — | — | US | disclosed |
| EP-0544166-A2 | Cephalosporinderivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1993-06-02 | — | — | EP | disclosed |