Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR4 | P51679 | 3/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CSF1R | P07333 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 2/20 | 0.33 |
| ▸ | MAOB | P27338 | 2/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.32 |
| ▸ | CDK4 | P11802 | 1/20 | 0.32 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.32 |
| ▸ | CCND1 | P24385 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | CDK7 | P50613 | 1/20 | 0.32 |
| ▸ | CDK9 | P50750 | 1/20 | 0.32 |
| ▸ | CCNH | P51946 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28504440 | 0.92 | CCR4 (0.39) | CCR4DRD2DRD3HRH4ACHE | |
| SCHEMBL28502430 | 0.91 | CCR4 (0.36) | CCR4DRD2DRD3HRH4ACHE | |
| SCHEMBL28504451 | 0.88 | ALDH1A1 (0.36) | CCR4SMN1; SMN2 | |
| SCHEMBL2798649 | 0.82 | DRD2 (0.49) | DRD2DRD3ACHECSF1RMAOB | |
| SCHEMBL24723411 | 0.81 | LPL (0.33) | CCR4HRH4ACHESMN1; SMN2 | |
| SCHEMBL19099105 | 0.81 | MEN1 (0.38) | SMN1; SMN2CSF1RMAOAMAOBSLC6A4 | |
| SCHEMBL2802127 | 0.80 | DRD2 (0.49) | DRD2DRD3CSF1R | |
| SCHEMBL28499596 | 0.79 | ROCK1 (0.39) | HRH4SMN1; SMN2 | |
| SCHEMBL24722850 | 0.78 | CCR4 (0.37) | CCR4HRH4SMN1; SMN2 | |
| SCHEMBL24722841 | 0.76 | HRH4 (0.35) | DRD2DRD3HRH4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112243439-A | Pyrrolo [2,3-B ] pyridines or pyrrolo [2,3-B ] pyrazines as HPK1 inhibitors and uses thereof | 百济神州有限公司 | 2021-01-19 | — | — | CN | disclosed |