Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 4/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.42 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL17384785 | 1.00 | EGFR (0.55) | EGFRKMT2AMEN1ALDH1A1MAPT | |
| SCHEMBL17373094 | 0.88 | NR4A2 (0.55) | EGFRKMT2AMEN1ALDH1A1CDK5 | |
| SCHEMBL19103249 | 0.85 | EGFR (0.55) | EGFRKMT2AMEN1ALDH1A1CDK5 | |
| SCHEMBL30239416 | 0.83 | EGFR (0.50) | EGFRKMT2AMEN1ALDH1A1MAPT | |
| SCHEMBL2951237 | 0.79 | ALDH1A1 (0.55) | KMT2AMEN1ALDH1A1MAPTLMNA | |
| SCHEMBL14719082 | 0.78 | CDK5 (0.52) | KMT2AMEN1ALDH1A1MAPTLMNA | |
| SCHEMBL30052020 | 0.78 | CDK5 (0.52) | KMT2AMEN1ALDH1A1MAPTLMNA | |
| SCHEMBL25497122 | 0.77 | CDK5 (0.49) | KMT2AMEN1ALDH1A1LMNACDK5 | |
| SCHEMBL17542583 | 0.77 | EGFR (0.49) | EGFRKMT2AMEN1ALDH1A1LMNA | |
| SCHEMBL30337269 | 0.77 | EGFR (0.49) | EGFRKMT2AMEN1ALDH1A1LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115974845-B | Preparation method of Ornitinib intermediate | 奥锐特药业股份有限公司 | 2024-09-20 | — | — | CN | disclosed |
| CN-115974845-A | Preparation method of oxitinib intermediate | 奥锐特药业股份有限公司 | 2023-04-18 | — | — | CN | disclosed |