Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NMT1 | P30419 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 3/20 | 0.44 |
| ▸ | HTR2C | P28335 | 3/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 3/20 | 0.43 |
| ▸ | DRD3 | P35462 | 3/20 | 0.43 |
| ▸ | HTR6 | P50406 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | AKT1 | P31749 | 6/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.41 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.41 |
| ▸ | AKT2 | P31751 | 1/20 | 0.41 |
| ▸ | GAB1 | Q13480 | 1/20 | 0.41 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL18425498 | 0.87 | ALDH1A1 (0.48) | NMT1CYP3A4AKT1ALDH1A1PDPK1 | |
| SCHEMBL22590668 | 0.87 | PHGDH (0.46) | NMT1HTR2AHTR2CDRD2DRD3 | |
| SCHEMBL25735584 | 0.85 | SMN1; SMN2 (0.45) | NMT1CYP3A4ALDH1A1NPC1RAB9A | |
| SCHEMBL25250241 | 0.85 | SMN1; SMN2 (0.47) | NMT1CYP3A4ALDH1A1NPC1RAB9A | |
| SCHEMBL25828673 | 0.82 | SMN1; SMN2 (0.44) | NMT1CYP3A4ALDH1A1NPC1RAB9A | |
| SCHEMBL25237942 | 0.81 | SMN1; SMN2 (0.48) | AKT1ALDH1A1PDPK1ABCB11AKT2 | |
| SCHEMBL30479932 | 0.81 | SMN1; SMN2 (0.48) | AKT1ALDH1A1PDPK1ABCB11AKT2 | |
| SCHEMBL25735583 | 0.80 | ALDH1A1 (0.45) | CYP1A2CYP3A4CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL18424453 | 0.79 | ALDH1A1 (0.50) | CYP3A4ALDH1A1NPC1RAB9AMEN1 | |
| SCHEMBL22590669 | 0.79 | ALDH1A1 (0.46) | CYP3A4AKT1ALDH1A1PDPK1ABCB11 |
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-4201928-A1 | BENZENE SULFONAMIDE THIAZOLE COMPOUNDS AND THEIR USE FOR THE TREATMENT OF CANCERS | Institut National de la Santé et de la Recherche Médicale (INSERM) (FR) | 2023-06-28 | — | — | EP | disclosed |