Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.34 |
| ▸ | GAA | P10253 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | VDR | P11473 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA3 | P07451 | 1/20 | 0.32 |
| ▸ | CA6 | P23280 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Ethylene Glycol SCHEMBL15272693 | 0.77 | KMT2A (0.38) | ALDH1A1GAAKMT2AMEN1CYP3A4 | |
| SCHEMBL11147861 | 0.74 | ALDH1A1 (0.38) | ALDH1A1GAAKMT2AMEN1CYP3A4 | |
| Ether SCHEMBL16685384 | 0.72 | GAA (0.45) | ALDH1A1GAAKMT2AMEN1CYP3A4 | |
| SCHEMBL10569448 | 0.72 | ALDH1A1 (0.40) | ALDH1A1GAAKMT2AMEN1CYP3A4 | |
| SCHEMBL7354211 | 0.71 | BCHE (0.44) | ALDH1A1KMT2AMEN1CYP3A4CYP1A2 | |
| SCHEMBL2383188 | 0.71 | ALDH1A1 (0.38) | ALDH1A1GAAKMT2AMEN1CYP3A4 | |
| SCHEMBL904362 | 0.71 | ALDH1A1 (0.40) | ALDH1A1GAAKMT2AMEN1CYP3A4 | |
| SCHEMBL28272751 | 0.70 | GAA (0.46) | ALDH1A1GAAKMT2AMEN1CYP3A4 | |
| SCHEMBL29367126 | 0.69 | GAA (0.50) | ALDH1A1GAAKMT2AMEN1CYP3A4 | |
| SCHEMBL14944048 | 0.69 | ALDH1A1 (0.43) | ALDH1A1GAAKMT2AMEN1CYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0772607-A1 | WATER-SOLUBLE METHINE COMPOUND AND PHARMACEUTICAL COMPOSITION FOR TREATMENT OF CANCER COMPRISING THE SAME | FUJI PHOTO FILM CO., LTD. (JP) | 1997-05-14 | — | — | EP | disclosed |
| US-5599825-A | ANTITUMOR AGENTS | FUJI PHOTO FILM CO., LTD. (JP) | 1997-02-04 | — | — | US | disclosed |
| WO-1996003393-A1 | WATER-SOLUBLE METHINE COMPOUND AND PHARMACEUTICAL COMPOSITION FOR TREATMENT OF CANCER COMPRISING THE SAME | FUJI PHOTO FILM CO., LTD. (JP) | 1996-02-08 | — | — | WO | disclosed |