Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 1/20 | 0.70 |
| ▸ | EGFR | P00533 | 5/20 | 0.69 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.63 |
| ▸ | MAPT | P10636 | 2/20 | 0.63 |
| ▸ | HTT | P42858 | 2/20 | 0.63 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.63 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.58 |
| ▸ | KIT | P10721 | 1/20 | 0.54 |
| ▸ | TTBK1 | Q5TCY1 | 1/20 | 0.53 |
| ▸ | TTBK2 | Q6IQ55 | 1/20 | 0.53 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.52 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL29199908 | 1.00 | ALK (0.70) | ALKEGFRABCG2ALDH1A1MAPT | |
| SCHEMBL3244626 | 0.92 | ALK (0.77) | ALKEGFRABCG2ALDH1A1MAPT | |
| SCHEMBL27878333 | 0.85 | USP2 (0.65) | ALKEGFRABCG2ALDH1A1MAPT | |
| SCHEMBL6665852 | 0.85 | ALK (0.70) | ALKEGFRABCG2ALDH1A1MAPT | |
| SCHEMBL28086863 | 0.85 | EGFR (0.77) | ALKEGFRABCG2ALDH1A1MAPT | |
| SCHEMBL4587672 | 0.83 | ALK (0.79) | ALKEGFRABCG2ALDH1A1MAPT | |
| SCHEMBL1192454 | 0.82 | EGFR (1.00) | ALKEGFRABCG2ALDH1A1MAPT | |
| Hydrochloric Acid SCHEMBL7763512 | 0.81 | ALK (0.69) | ALKEGFRABCG2ALDH1A1MAPT | |
| SCHEMBL29116258 | 0.81 | ABCG2 (0.74) | ALKEGFRABCG2ALDH1A1MAPT | |
| Hydrochloric Acid SCHEMBL7760844 | 0.81 | EGFR (0.60) | ALKEGFRABCG2ALDH1A1MAPT |
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-112204010-B | Heterocyclic derivatives and uses thereof | C&C新药研究所 | 2024-03-19 | — | — | CN | disclosed |