Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.39 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.39 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.38 |
| ▸ | KDM5A | P29375 | 2/20 | 0.37 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.37 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.37 |
| ▸ | BMPR1B | O00238 | 7/20 | 0.35 |
| ▸ | BMPR1A | P36894 | 7/20 | 0.35 |
| ▸ | TGFBR1 | P36897 | 7/20 | 0.35 |
| ▸ | ACVRL1 | P37023 | 7/20 | 0.35 |
| ▸ | ACVR1 | Q04771 | 7/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.35 |
| ▸ | MET | P08581 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | AXL | P30530 | 1/20 | 0.34 |
| ▸ | MERTK | Q12866 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30508316 | 0.90 | HDAC3 (0.41) | HDAC3HDAC1HDAC2IKBKETBK1 | |
| SCHEMBL29041963 | 0.90 | HDAC3 (0.41) | HDAC3HDAC1HDAC2IKBKETBK1 | |
| SCHEMBL30508285 | 0.88 | HDAC3 (0.55) | HDAC3HDAC1HDAC2IKBKETBK1 | |
| SCHEMBL30508332 | 0.87 | BMPR1B (0.51) | HDAC3HDAC1HDAC2IKBKETBK1 | |
| SCHEMBL29042097 | 0.78 | HDAC3 (0.52) | HDAC3HDAC1HDAC2IKBKETBK1 | |
| SCHEMBL30508338 | 0.78 | HDAC3 (0.52) | HDAC3HDAC1HDAC2IKBKETBK1 | |
| SCHEMBL30508377 | 0.77 | BMPR1B (0.61) | HDAC3HDAC1HDAC2IKBKETBK1 | |
| SCHEMBL30508228 | 0.75 | BMPR1B (0.43) | PIK3C3BMPR1BBMPR1ATGFBR1ACVRL1 | |
| SCHEMBL29041989 | 0.71 | MCHR1 (0.39) | HDAC3HDAC1HDAC2MCHR1 | |
| SCHEMBL30508339 | 0.69 | MET (0.44) | PIK3C3BMPR1BBMPR1ATGFBR1ACVRL1 |
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-116478145-B | ALK2 kinase inhibitors | 杭州邦顺制药有限公司 | 2024-02-02 | — | — | CN | disclosed |
| CN-116478145-A | ALK2 kinase inhibitors | 杭州邦顺制药有限公司 | 2023-07-25 | — | — | CN | disclosed |