Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | NR1D1 | P20393 | 1/20 | 0.36 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL26422995 | 0.87 | MAPK1 (0.44) | MAPK1TSHRLMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL29599933 | 0.87 | MAPK1 (0.44) | MAPK1TSHRLMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL3247412 | 0.86 | MAPK1 (0.43) | MAPK1TSHRLMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL27832441 | 0.84 | MAPK1 (0.41) | MAPK1TSHRLMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL28376618 | 0.81 | MAPK1 (0.39) | MAPK1TSHRLMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL4550172 | 0.79 | MAPK1 (0.45) | MAPK1TSHRLMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL1067023 | 0.79 | HCAR3 (0.34) | LMNAALDH1A1SMN1; SMN2MAPTKMT2A | |
| SCHEMBL16654154 | 0.77 | HCAR3 (0.38) | MAPK1LMNAALDH1A1SMN1; SMN2L3MBTL1 | |
| SCHEMBL21326464 | 0.76 | MAPK1 (0.43) | MAPK1TSHRLMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL1186362 | 0.74 | TDP1 (0.52) | MAPK1TSHRLMNAALDH1A1SMN1; SMN2 |
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-114853730-A | Compound used as HPK1 kinase inhibitor and preparation method and application thereof | 中国药科大学 | 2022-08-05 | — | — | CN | disclosed |