Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 4/20 | 0.54 |
| ▸ | DRD4 | P21917 | 4/20 | 0.54 |
| ▸ | DRD3 | P35462 | 3/20 | 0.52 |
| ▸ | F2 | P00734 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL24061152 | 0.78 | L3MBTL1 (0.62) | DRD2DRD4DRD3POLBL3MBTL1 | |
| SCHEMBL8265682 | 0.77 | ALDH1A1 (0.52) | DRD2DRD4DRD3F2POLB | |
| SCHEMBL18655581 | 0.76 | TSHR (0.59) | DRD2DRD4SMN1; SMN2CYP1A2CYP2D6 | |
| SCHEMBL12958255 | 0.76 | DRD2 (0.48) | DRD2DRD4DRD3SMN1; SMN2KDM4E | |
| SCHEMBL18655582 | 0.76 | TSHR (0.59) | DRD2DRD4SMN1; SMN2CYP1A2CYP2D6 | |
| SCHEMBL8264819 | 0.75 | MAOB (0.58) | DRD2DRD4KMT2ASMN1; SMN2KDM4E | |
| SCHEMBL14308606 | 0.73 | DRD2 (0.69) | DRD2DRD4DRD3F2POLB | |
| SCHEMBL31663663 | 0.73 | DRD2 (0.84) | DRD2DRD4DRD3F2POLB | |
| SCHEMBL23067879 | 0.73 | DRD2 (0.84) | DRD2DRD4DRD3F2POLB | |
| SCHEMBL12225772 | 0.73 | RXRA (0.57) | SMN1; SMN2KDM4EL3MBTL1MAPK1HPGD |
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-4157844-B1 | 4-(7H-PYRROLO[2,3-D]PYRIMIDIN-4-YL)-3,6-DIHYDROPYRIDINE-1-(2H)-CARBOXAMIDE DERIVATIVES AS LIMK AND/OR ROCK KINASES INHIBITORS FOR USE IN THE TREATMENT OF CANCER | CENTRE NAT RECH SCIENT (FR) | 2024-07-10 | — | — | EP | disclosed |