Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.77 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.77 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.77 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | ACP3 | P15309 | 1/20 | 0.43 |
| ▸ | METAP2 | P50579 | 1/20 | 0.42 |
| ▸ | METAP1 | P53582 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9456743 | 0.87 | CYP1A2 (1.00) | CYP1A2CYP2C19CYP2C9HPGDCYP2D6 | |
| SCHEMBL28999594 | 0.83 | CYP1A2 (0.53) | CYP1A2CYP2C19CYP2C9HPGDCYP2D6 | |
| SCHEMBL20734682 | 0.81 | CYP1A2 (0.50) | CYP1A2CYP2C19CYP2C9HPGDCYP2D6 | |
| SCHEMBL3069772 | 0.80 | CYP1A2 (0.44) | CYP1A2CYP2C19CYP2C9HPGDCYP2D6 | |
| SCHEMBL9280807 | 0.79 | CYP1A2 (0.69) | CYP1A2CYP2C19CYP2C9HPGDCYP2D6 | |
| SCHEMBL271107 | 0.79 | CYP1A2 (0.69) | CYP1A2CYP2C19CYP2C9HPGDCYP2D6 | |
| SCHEMBL12854049 | 0.78 | CYP1A2 (0.47) | CYP1A2CYP2C19CYP2C9HPGDCYP2D6 | |
| SCHEMBL9867788 | 0.77 | CYP1A2 (0.71) | CYP1A2CYP2C19CYP2C9HPGDCYP2D6 | |
| SCHEMBL20734670 | 0.77 | CYP1A2 (0.43) | CYP1A2CYP2C19CYP2C9ALDH1A1KMT2A | |
| SCHEMBL30365968 | 0.76 | CYP1A2 (0.59) | CYP1A2CYP2C19CYP2C9HPGDCYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1112251-A1 | AZETIDINE DERIVATIVES, PREPARATION AND MEDICINES CONTAINING THEM | Aventis Pharma S.A. (FR) | 2001-07-04 | — | — | EP | disclosed |
| WO-2000015609-A1 | AZETIDINE DERIVATIVES, PREPARATION AND MEDICINES CONTAINING THEM | AVENTIS PHARMA S.A. (FR) | 2000-03-23 | — | — | WO | disclosed |