Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 7/20 | 0.40 |
| ▸ | DRD4 | P21917 | 7/20 | 0.40 |
| ▸ | DRD3 | P35462 | 7/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | IGF1R | P08069 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TDO2 | P48775 | 1/20 | 0.32 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.31 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4460763 | 0.81 | NOTUM (0.50) | DRD2DRD4DRD3CYP1A2CYP2C9 | |
| SCHEMBL4464376 | 0.78 | CA12 (0.38) | CA12CA9CYP1A2NPC1IGF1R | |
| SCHEMBL4464611 | 0.74 | SMN1; SMN2 (0.47) | CA12CA9CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL4457103 | 0.70 | TAAR1 (0.42) | HSD17B10SMN1; SMN2ALDH1A1HPGDTDP1 | |
| SCHEMBL15029059 | 0.69 | CA12 (0.49) | DRD2DRD4DRD3CA12CA9 | |
| SCHEMBL14896296 | 0.67 | HSD17B10 (0.50) | DRD2DRD4DRD3CA12CA9 | |
| SCHEMBL5732649 | 0.66 | CA12 (0.49) | DRD2DRD4DRD3CA12CA9 | |
| SCHEMBL4466582 | 0.65 | MAPT (0.36) | CYP2C9HSD17B10ALDH1A1MEN1MAPT | |
| SCHEMBL7020024 | 0.64 | KDM4E (0.47) | DRD2DRD4DRD3CA12CA9 | |
| SCHEMBL6768359 | 0.64 | DRD2 (0.49) | DRD2DRD4DRD3CA12CA9 |
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-2009017838-A2 | COMBINATIONS OF JAK-2 INHIBITORS AND OTHER AGENTS | EXELIXIS, INC. (US) | 2009-02-05 | — | — | WO | disclosed |