Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | AHR | P35869 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.30 |
| ▸ | TP53 | P04637 | 2/20 | 0.30 |
| ▸ | POLB | P06746 | 2/20 | 0.30 |
| ▸ | GMNN | O75496 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | ELANE | P08246 | 1/20 | 0.30 |
| ▸ | CTSG | P08311 | 1/20 | 0.30 |
| ▸ | CTSA | P10619 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22655415 | 1.00 | AKR1B1 (0.35) | AKR1B1LMNANPSR1PPARGNCOA2 | |
| SCHEMBL22655393 | 0.84 | ESR2 (0.33) | ESR2ESR1GPR35 | |
| SCHEMBL30979545 | 0.84 | ESR2 (0.33) | ESR2ESR1GPR35 | |
| SCHEMBL22655392 | 0.83 | NPC1 (0.40) | LMNAESR2ESR1POLBALDH1A1 | |
| SCHEMBL22655416 | 0.83 | NPC1 (0.40) | LMNAESR2ESR1POLBALDH1A1 | |
| SCHEMBL22655397 | 0.78 | KMT2A (0.44) | LMNAESR1CYP1A2TP53POLB | |
| SCHEMBL22655395 | 0.78 | KMT2A (0.44) | LMNAESR1CYP1A2TP53POLB | |
| SCHEMBL22655410 | 0.77 | CES1 (0.46) | LMNAESR2ESR1CYP1A2TP53 | |
| SCHEMBL22667193 | 0.74 | CYP1A2 (0.49) | LMNAESR2CYP1A2MAPTBLM | |
| SCHEMBL22667191 | 0.74 | CYP1A2 (0.49) | LMNAESR2CYP1A2MAPTBLM |
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 |
|---|---|---|---|---|---|---|---|
| EP-3601294-B1 | ATF3 INDUCTION COMPOUNDS | UNIV TAIPEI MEDICAL (TW) | 2024-07-10 | — | — | EP | disclosed |