Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 1/20 | 0.53 |
| ▸ | AURKA | O14965 | 9/20 | 0.42 |
| ▸ | AURKB | Q96GD4 | 7/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 5/20 | 0.41 |
| ▸ | SRC | P12931 | 4/20 | 0.41 |
| ▸ | ITK | Q08881 | 1/20 | 0.40 |
| ▸ | IGF1R | P08069 | 1/20 | 0.39 |
| ▸ | GSK3A | P49840 | 2/20 | 0.39 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.39 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.39 |
| ▸ | CDK2 | P24941 | 2/20 | 0.39 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.39 |
| ▸ | PLK4 | O00444 | 2/20 | 0.39 |
| ▸ | PAK4 | O96013 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9820151 | 0.75 | MEN1 (0.65) | DHODHAURKAAURKBMEN1KMT2A | |
| SCHEMBL28379379 | 0.75 | DHODH (0.54) | DHODHAURKAAURKBMEN1KMT2A | |
| SCHEMBL4815907 | 0.72 | DHODH (0.64) | DHODHAURKAAURKBMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL4808013 | 0.71 | DHODH (0.62) | DHODHAURKAAURKBMEN1KMT2A | |
| SCHEMBL27669738 | 0.70 | MAPKAPK2 (0.31) | — | |
| SCHEMBL9820128 | 0.70 | DHODH (0.60) | DHODHAURKAAURKBMEN1KMT2A | |
| SCHEMBL3967580 | 0.70 | AURKA (0.45) | AURKAAURKBGSK3BSRCITK | |
| SCHEMBL15553740 | 0.69 | MAPK10 (0.44) | GSK3BGSK3ACDK2 | |
| SCHEMBL14293657 | 0.69 | DHODH (0.59) | DHODHAURKAAURKBMEN1KMT2A | |
| SCHEMBL10670531 | 0.67 | MEN1 (0.52) | MEN1KMT2ATP53GAAMAPT |
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-115916747-A | Fused heterocyclic derivative and application thereof in medicine | 四川海思科制药有限公司 | 2023-04-04 | — | — | CN | disclosed |