Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 1/20 | 0.41 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.41 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | RAF1 | P04049 | 3/20 | 0.38 |
| ▸ | BRAF | P15056 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.37 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28294334 | 0.88 | LOXL2 (0.46) | SCN9ALOXL2KMT2ARAF1MEN1 | |
| SCHEMBL28292621 | 0.87 | BRAF (0.46) | LOXL2KMT2ARAF1BRAFMEN1 | |
| SCHEMBL28294317 | 0.82 | SCN9A (0.45) | SCN9ACYP4F2CYP4A11KMT2A | |
| SCHEMBL28963812 | 0.80 | SCN9A (0.40) | SCN9ALOXL2KMT2ARAF1BRAF | |
| SCHEMBL28940983 | 0.80 | SCN9A (0.40) | SCN9ALOXL2KMT2ARAF1BRAF | |
| SCHEMBL28292592 | 0.79 | KDR (0.53) | KMT2ARAF1BRAFMEN1KDR | |
| SCHEMBL28941005 | 0.79 | SCN9A (0.38) | SCN9ACYP4F2CYP4A11 | |
| SCHEMBL28940925 | 0.76 | CYP2D6 (0.46) | LOXL2KMT2AMEN1AR | |
| SCHEMBL28940943 | 0.75 | ANO1 (0.48) | AR | |
| SCHEMBL29262259 | 0.74 | MEN1 (0.48) | KMT2ARAF1MEN1ALDH1A1SMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109689647-B | Bicyclic heteroaryl substituted compounds | 百时美施贵宝公司 | 2023-01-20 | — | — | CN | claimed |
| CN-109689647-B | Bicyclic heteroaryl substituted compounds | 百时美施贵宝公司 | 2023-01-20 | — | — | CN | disclosed |
| CN-109689647-A | The compound that bicyclic heteroaryl replaces | 百时美施贵宝公司 | 2019-04-26 | — | — | CN | disclosed |