Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | ERN1 | O75460 | 4/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6288703 | 0.87 | ERN1 (0.55) | ALDH1A1MAPTKMT2AMEN1MTNR1A | |
| SCHEMBL28755555 | 0.81 | ALDH1A1 (0.56) | ALDH1A1MAPTHPGDKMT2AMEN1 | |
| SCHEMBL22750623 | 0.80 | ERN1 (0.62) | ALDH1A1MAPTHPGDERN1 | |
| SCHEMBL31364601 | 0.80 | ALDH1A1 (0.54) | ALDH1A1MAPTHPGDKMT2AMEN1 | |
| SCHEMBL30067092 | 0.80 | ERN1 (0.46) | ALDH1A1MAPTHPGDCYP1A2CYP2C9 | |
| SCHEMBL8989547 | 0.80 | ERN1 (0.46) | ALDH1A1MAPTHPGDCYP1A2CYP2C9 | |
| SCHEMBL30067105 | 0.80 | MTNR1A (0.48) | ALDH1A1HPGDKMT2AMEN1MTNR1A | |
| SCHEMBL7736295 | 0.79 | NCEH1 (0.53) | ALDH1A1MAPTHPGDKMT2AMEN1 | |
| SCHEMBL11809956 | 0.79 | ALDH1A1 (0.53) | ALDH1A1MAPTHPGDKMT2AMEN1 | |
| SCHEMBL11078616 | 0.79 | ALDH1A1 (0.53) | ALDH1A1MAPTHPGDKMT2AMEN1 |
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-2022233824-A1 | NAPHTHALENE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER | INSTITUT CURIE (FR) | 2022-11-10 | — | — | WO | disclosed |