Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | HTR4 | Q13639 | 4/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | HTR3A | P46098 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | SLC29A1 | Q99808 | 2/20 | 0.46 |
| ▸ | CSF1R | P07333 | 2/20 | 0.46 |
| ▸ | EHMT2 | Q96KQ7 | 4/20 | 0.46 |
| ▸ | EHMT1 | Q9H9B1 | 4/20 | 0.46 |
| ▸ | EGFR | P00533 | 4/20 | 0.45 |
| ▸ | KDR | P35968 | 4/20 | 0.45 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL17375500 | 1.00 | KDM4E (0.58) | KDM4EHTR4CYP3A4ALDH1A1MEN1 | |
| SCHEMBL19260656 | 0.92 | KDM4E (0.59) | KDM4EHTR4CYP3A4ALDH1A1MEN1 | |
| SCHEMBL4379114 | 0.91 | HTR4 (0.60) | KDM4EHTR4CYP3A4ALDH1A1MEN1 | |
| SCHEMBL17375537 | 0.89 | HTR4 (0.47) | KDM4EHTR4CYP3A4ALDH1A1MEN1 | |
| SCHEMBL3711173 | 0.89 | LMNA (0.56) | KDM4EHTR4CYP3A4ALDH1A1MEN1 | |
| SCHEMBL3471214 | 0.89 | LMNA (0.56) | KDM4EHTR4CYP3A4ALDH1A1MEN1 | |
| SCHEMBL17375521 | 0.82 | SIRT6 (0.51) | KDM4ECYP3A4ALDH1A1CYP2D6LMNA | |
| SCHEMBL2926517 | 0.81 | HTR4 (0.56) | HTR4CYP3A4ALDH1A1MEN1CYP2D6 | |
| SCHEMBL19260705 | 0.81 | HTR4 (0.56) | HTR4CYP3A4ALDH1A1MEN1CYP2D6 | |
| SCHEMBL6336768 | 0.81 | HTR4 (0.62) | HTR4CYP3A4ALDH1A1MEN1CYP2D6 |
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-111646940-B | Preparation method of bosutinib intermediate | 鲁南制药集团股份有限公司 | 2024-01-30 | — | — | CN | disclosed |