Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.55 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.55 |
| ▸ | IKBKE | Q14164 | 4/20 | 0.51 |
| ▸ | TBK1 | Q9UHD2 | 4/20 | 0.51 |
| ▸ | BMPR1B | O00238 | 7/20 | 0.45 |
| ▸ | BMPR1A | P36894 | 7/20 | 0.45 |
| ▸ | TGFBR1 | P36897 | 7/20 | 0.45 |
| ▸ | ACVRL1 | P37023 | 7/20 | 0.45 |
| ▸ | ACVR1 | Q04771 | 7/20 | 0.45 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.43 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.41 |
| ▸ | GRK5 | P34947 | 1/20 | 0.40 |
| ▸ | ATR | Q13535 | 1/20 | 0.40 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.39 |
| ▸ | AXL | P30530 | 1/20 | 0.39 |
| ▸ | MERTK | Q12866 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29042097 | 0.89 | HDAC3 (0.52) | HDAC3HDAC1HDAC2IKBKETBK1 | |
| SCHEMBL30508338 | 0.89 | HDAC3 (0.52) | HDAC3HDAC1HDAC2IKBKETBK1 | |
| SCHEMBL30508200 | 0.88 | HDAC3 (0.43) | HDAC3HDAC1HDAC2IKBKETBK1 | |
| SCHEMBL30508377 | 0.84 | BMPR1B (0.61) | HDAC3HDAC1HDAC2IKBKETBK1 | |
| SCHEMBL30508339 | 0.78 | MET (0.44) | BMPR1BBMPR1ATGFBR1ACVRL1ACVR1 | |
| SCHEMBL29041963 | 0.78 | HDAC3 (0.41) | HDAC3HDAC1HDAC2IKBKETBK1 | |
| SCHEMBL30508316 | 0.78 | HDAC3 (0.41) | HDAC3HDAC1HDAC2IKBKETBK1 | |
| SCHEMBL30508336 | 0.77 | ACVR1 (0.64) | BMPR1BBMPR1ATGFBR1ACVRL1ACVR1 | |
| SCHEMBL15681625 | 0.77 | HDAC3 (0.61) | HDAC3HDAC1HDAC2PIK3CAMCHR1 | |
| SCHEMBL30508238 | 0.76 | LRRK2 (0.57) | IKBKETBK1BMPR1BBMPR1ATGFBR1 |
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-116478145-B | ALK2 kinase inhibitors | 杭州邦顺制药有限公司 | 2024-02-02 | — | — | CN | disclosed |
| WO-2023198114-A1 | ALK2 KINASE INHIBITOR | 杭州邦顺制药有限公司 | 2023-10-19 | — | — | WO | disclosed |
| CN-116478145-A | ALK2 kinase inhibitors | 杭州邦顺制药有限公司 | 2023-07-25 | — | — | CN | disclosed |