Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 7/20 | 0.64 |
| ▸ | EGFR | P00533 | 3/20 | 0.64 |
| ▸ | KDR | P35968 | 3/20 | 0.64 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.64 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.64 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.64 |
| ▸ | LTK | P29376 | 1/20 | 0.64 |
| ▸ | GRK5 | P34947 | 1/20 | 0.64 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.64 |
| ▸ | CDK8 | P49336 | 1/20 | 0.64 |
| ▸ | CDK7 | P50613 | 1/20 | 0.64 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.64 |
| ▸ | NEK4 | P51957 | 1/20 | 0.64 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.64 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.64 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.64 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.64 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.64 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.64 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL31098947 | 0.84 | RAB9A (0.59) | ABCG2EGFRKDRHTTNPC1 | |
| SCHEMBL30754730 | 0.82 | MEN1 (0.65) | ABCG2EGFRKDRDYRK3MAP4K4 | |
| SCHEMBL20356686 | 0.81 | EGFR (0.61) | ABCG2EGFRKDRHTTLMNA | |
| SCHEMBL26929257 | 0.81 | EGFR (0.53) | ABCG2EGFRKDRDYRK3MAP4K4 | |
| SCHEMBL7127641 | 0.80 | AHR (0.58) | EGFRKDRLMNAMEN1KMT2A | |
| SCHEMBL1921849 | 0.78 | ABCG2 (0.53) | ABCG2EGFRMAP4K4LTKMAPK8 | |
| SCHEMBL4933191 | 0.78 | TNF (0.64) | ABCG2EGFRSMN1; SMN2CYP1A2MEN1 | |
| SCHEMBL26789989 | 0.78 | TNF (0.64) | ABCG2EGFRAURKBABCB1EPAS1 | |
| SCHEMBL7691978 | 0.78 | ABCG2 (0.59) | ABCG2EGFRKDRDYRK3MAP4K4 | |
| SCHEMBL9017043 | 0.78 | EGFR (1.00) | ABCG2EGFRKDRDYRK3MAP4K4 |
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-112390755-B | Heteroaryl method for amine | 中国科学院理化技术研究所 | 2024-08-02 | — | — | CN | claimed |