Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKMYT1 | Q99640 | 1/20 | 0.38 |
| ▸ | CDK7 | P50613 | 1/20 | 0.37 |
| ▸ | CDK9 | P50750 | 1/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | AURKA | O14965 | 2/20 | 0.35 |
| ▸ | YTHDC1 | Q96MU7 | 2/20 | 0.35 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.35 |
| ▸ | INSR | P06213 | 1/20 | 0.35 |
| ▸ | S100A9 | P06702 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.34 |
| ▸ | IGF1R | P08069 | 1/20 | 0.34 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.34 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30833643 | 0.88 | ALK (0.43) | CDK7CDK9TRPV1AURKAALK | |
| SCHEMBL30833659 | 0.85 | AURKA (0.48) | CDK7CDK9TRPV1AURKAALK | |
| SCHEMBL30833796 | 0.85 | IGF1R (0.46) | CDK7CDK9TRPV1AURKAALK | |
| SCHEMBL30833733 | 0.85 | PIN1 (0.36) | CDK7CDK9TRPV1GAAAURKA | |
| SCHEMBL30833703 | 0.82 | TRPV1 (0.47) | CDK7CDK9TRPV1YTHDC1AURKB | |
| SCHEMBL30833754 | 0.78 | MAPT (0.36) | CDK9GAAAURKAYTHDC1MAPT | |
| SCHEMBL25005167 | 0.78 | BRD4 (0.43) | PKMYT1CDK7CDK9AURKAALK | |
| SCHEMBL29904714 | 0.78 | ALK (0.48) | CDK7CDK9YTHDC1ALKINSR | |
| SCHEMBL31147615 | 0.78 | BRD4 (0.43) | PKMYT1CDK7CDK9AURKAALK | |
| SCHEMBL26906809 | 0.78 | ALK (0.48) | CDK7CDK9YTHDC1ALKINSR |
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-113896744-B | Selective EGFR inhibitor | 成都先导药物开发股份有限公司 | 2024-04-16 | — | — | CN | disclosed |