Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 8/20 | 0.59 |
| ▸ | DRD2 | P14416 | 6/20 | 0.59 |
| ▸ | DRD3 | P35462 | 6/20 | 0.59 |
| ▸ | PLK4 | O00444 | 1/20 | 0.46 |
| ▸ | AURKA | O14965 | 1/20 | 0.46 |
| ▸ | JAK2 | O60674 | 1/20 | 0.46 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.46 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.46 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.46 |
| ▸ | PRKCG | P05129 | 1/20 | 0.46 |
| ▸ | INSR | P06213 | 1/20 | 0.46 |
| ▸ | CDK1 | P06493 | 1/20 | 0.46 |
| ▸ | FES | P07332 | 1/20 | 0.46 |
| ▸ | IGF1R | P08069 | 1/20 | 0.46 |
| ▸ | ROS1 | P08922 | 1/20 | 0.46 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.46 |
| ▸ | PHKG2 | P15735 | 1/20 | 0.46 |
| ▸ | FER | P16591 | 1/20 | 0.46 |
| ▸ | FLT1 | P17948 | 1/20 | 0.46 |
| ▸ | CDK2 | P24941 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL16913887 | 0.81 | LMNA (0.44) | DRD4DRD2DRD3PLK4AURKA | |
| SCHEMBL30007886 | 0.77 | GFER (0.47) | DRD4DRD2DRD3PLK4AURKA | |
| SCHEMBL29215986 | 0.77 | EGFR (0.47) | DRD4DRD2DRD3PLK4AURKA | |
| SCHEMBL30007369 | 0.76 | DRD2 (0.47) | DRD4DRD2DRD3INSRCDK2 | |
| SCHEMBL30008538 | 0.76 | ALDH1A1 (0.41) | DRD4DRD2DRD3HTR2AKMT2A | |
| SCHEMBL28604136 | 0.75 | SOS1 (0.42) | DRD4DRD2DRD3JAK2JAK3 | |
| SCHEMBL29204307 | 0.70 | MAP4K1 (0.64) | PLK4AURKAJAK2ROCK2PRKD3 | |
| SCHEMBL22619026 | 0.69 | DRD2 (0.87) | DRD4DRD2DRD3JAK2KMT2A | |
| SCHEMBL31326340 | 0.69 | MPO (0.47) | DRD4DRD2DRD3PLK4AURKA | |
| SCHEMBL31326325 | 0.69 | HTR2A (0.48) | DRD4DRD2DRD3PLK4AURKA |
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-2022237922-A1 | ANTITUMOR COMPOUNDS BASED ON NITROGEN HETEROCYCLES AND USE THEREOF AS MEDICAMENTS | FAKULTNI NEMOCNICE HRADEC KRALOVE (CZ) | 2022-11-17 | — | — | WO | disclosed |