Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BMPR1B | O00238 | 6/20 | 0.44 |
| ▸ | BMPR1A | P36894 | 6/20 | 0.44 |
| ▸ | TGFBR1 | P36897 | 6/20 | 0.44 |
| ▸ | ACVRL1 | P37023 | 6/20 | 0.44 |
| ▸ | ACVR1 | Q04771 | 6/20 | 0.44 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.39 |
| ▸ | ACHE | P22303 | 3/20 | 0.39 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.39 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.38 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.36 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.36 |
| ▸ | AXL | P30530 | 2/20 | 0.35 |
| ▸ | MERTK | Q12866 | 2/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 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 | |
|---|---|---|---|---|
| SCHEMBL18617173 | 0.81 | HRH3 (0.50) | CHEK1ACHELRRK2HRH3 | |
| SCHEMBL24318152 | 0.78 | BMPR1B (0.58) | BMPR1BBMPR1ATGFBR1ACVRL1ACVR1 | |
| SCHEMBL30508373 | 0.74 | BMPR1B (0.70) | BMPR1BBMPR1ATGFBR1ACVRL1ACVR1 | |
| SCHEMBL19806937 | 0.74 | BMPR1B (0.72) | BMPR1BBMPR1ATGFBR1ACVRL1ACVR1 | |
| SCHEMBL19806900 | 0.72 | BMPR1B (0.70) | BMPR1BBMPR1ATGFBR1ACVRL1ACVR1 | |
| SCHEMBL13572723 | 0.72 | CHEK1 (0.62) | CHEK1ACHE | |
| SCHEMBL14764263 | 0.70 | TLR8 (0.39) | CHEK1ACHETLR8TLR7KCNH2 | |
| SCHEMBL18615838 | 0.69 | MAP4K4 (0.51) | — | |
| SCHEMBL2561425 | 0.68 | MAP4K4 (0.51) | HDAC1HDAC2 | |
| SCHEMBL14276837 | 0.68 | MAP4K4 (0.49) | AXL |
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 |
|---|---|---|---|---|---|---|---|
| EP-3971177-A1 | AMINOPYRIDINE DERIVATIVES AND THEIR USE AS SELECTIVE ALK-2 INHIBITORS | Novartis AG (CH) | 2022-03-23 | — | — | EP | disclosed |