Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 2/20 | 0.46 |
| ▸ | DRD3 | P35462 | 2/20 | 0.46 |
| ▸ | HTR1D | P28221 | 2/20 | 0.44 |
| ▸ | HTR1B | P28222 | 2/20 | 0.44 |
| ▸ | HTR2A | P28223 | 2/20 | 0.44 |
| ▸ | CCR4 | P51679 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | HTR1E | P28566 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9522305 | 0.83 | MAPT (0.46) | MAPTMAPK1DRD2DRD3HTR1D | |
| SCHEMBL8873991 | 0.81 | KMT2A (0.54) | MAPTMAPK1DRD2DRD3KDM4E | |
| SCHEMBL6972658 | 0.81 | DRD2 (0.46) | MAPTMAPK1DRD2DRD3CCR4 | |
| SCHEMBL21447973 | 0.79 | DRD3 (0.56) | MAPTMAPK1DRD2DRD3HTR1D | |
| SCHEMBL6975643 | 0.75 | ACVR1 (0.45) | MAPTMAPK1DRD2DRD3HTR1D | |
| SCHEMBL6974027 | 0.75 | SIRT6 (0.61) | MAPTMAPK1ALDH1A1HTR6POLB | |
| SCHEMBL21388456 | 0.74 | MAPT (0.43) | MAPTMAPK1DRD2DRD3HTR1D | |
| SCHEMBL6971975 | 0.73 | DRD3 (0.57) | MAPTDRD2DRD3HTR1DHTR1B | |
| SCHEMBL28513873 | 0.73 | GAA (0.51) | MAPTMAPK1DRD2DRD3HTR1D | |
| SCHEMBL2384047 | 0.72 | SIRT6 (0.58) | MAPTMAPK1DRD2DRD3KDM4E |
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 2 patents. 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 |
| WO-2019238067-A1 | PYRROLO [2, 3-B] PYRIDINES OR PYRROLO [2, 3-B] PYRAZINES AS HPK1 INHIBITOR AND THE USE THEREOF | BEIGENE, LTD. (KY) | 2019-12-19 | — | — | WO | disclosed |