Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.51 |
| ▸ | MAOA | P21397 | 1/20 | 0.51 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.50 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.50 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.50 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.49 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.49 |
| ▸ | SPHK2 | Q9NRA0 | 4/20 | 0.48 |
| ▸ | SPHK1 | Q9NYA1 | 4/20 | 0.48 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.45 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.45 |
| ▸ | MAP2K7 | O14733 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL31172257 | 0.86 | PTPN1 (0.55) | MAOBPDK1PDK2PDK3PDK4 | |
| SCHEMBL28600778 | 0.84 | PDK1 (0.47) | PDK1PDK2PDK3PDK4SIRT2 | |
| SCHEMBL15746920 | 0.82 | MEN1 (0.53) | PDK1PDK2PDK3PDK4LMNA | |
| SCHEMBL29351023 | 0.82 | MEN1 (0.53) | PDK1PDK2PDK3PDK4LMNA | |
| SCHEMBL22920172 | 0.81 | PDK1 (0.65) | MAOBPDK1PDK2PDK3PDK4 | |
| SCHEMBL29910262 | 0.81 | PDK1 (0.65) | MAOBPDK1PDK2PDK3PDK4 | |
| SCHEMBL6470532 | 0.78 | HTT (0.58) | LMNAPOLBTAAR1 | |
| SCHEMBL30108116 | 0.77 | PDK1 (0.42) | PDK1PDK2PDK3PDK4SIRT2 | |
| SCHEMBL26507166 | 0.77 | PDK1 (0.42) | PDK1PDK2PDK3PDK4SIRT2 | |
| SCHEMBL15613736 | 0.76 | MAOB (0.58) | MAOBMAOASPHK2SPHK1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-113264874-B | Substituted diaryl urea derivative and preparation method and application thereof | 华东理工大学 | 2024-12-03 | — | — | CN | disclosed |
| CN-113264874-A | Substituted diaryl urea derivative and preparation method and application thereof | 华东理工大学 | 2021-08-17 | — | — | CN | disclosed |