Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIT | P10721 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | DHFR | P00374 | 3/20 | 0.37 |
| ▸ | DCPS | Q96C86 | 2/20 | 0.37 |
| ▸ | EGFR | P00533 | 2/20 | 0.36 |
| ▸ | CSF1R | P07333 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 4/20 | 0.36 |
| ▸ | EPHA2 | P29317 | 2/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | HTR1D | P28221 | 1/20 | 0.36 |
| ▸ | HTR1B | P28222 | 1/20 | 0.36 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | FLT1 | P17948 | 1/20 | 0.35 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28892526 | 0.83 | SCN1A (0.47) | — | |
| SCHEMBL30002548 | 0.83 | SCN1A (0.47) | — | |
| SCHEMBL30003246 | 0.82 | GAA (0.40) | KMT2AEGFRALDH1A1HTR1APKM | |
| SCHEMBL28892628 | 0.82 | GAA (0.40) | KMT2AEGFRALDH1A1HTR1APKM | |
| SCHEMBL30002031 | 0.79 | DHFR (0.38) | KITKMT2ADHFRDCPSCSF1R | |
| SCHEMBL28892213 | 0.78 | KIT (0.37) | KITKMT2AEGFRCSF1RKDR | |
| SCHEMBL30002637 | 0.78 | KIT (0.37) | KITKMT2AEGFRCSF1RKDR | |
| SCHEMBL30002519 | 0.77 | DHFR (0.37) | KITKMT2ADHFRDCPSCSF1R | |
| SCHEMBL29211328 | 0.77 | DHFR (0.37) | KITKMT2ADHFRDCPSCSF1R | |
| SCHEMBL30002665 | 0.76 | SCN1A (0.37) | KITKDREPHA2ERBB2FLT1 |
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-115232144-B | Nitrogen-containing condensed ring derivative, pharmaceutical composition, and preparation method and application thereof | 长春金赛药业有限责任公司 | 2024-04-02 | — | — | CN | disclosed |
| CN-115232144-A | Nitrogen-containing fused ring derivative, pharmaceutical composition, preparation method and application thereof | 长春金赛药业有限责任公司 | 2022-10-25 | — | — | CN | disclosed |