Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBK1 | Q9UHD2 | 11/20 | 0.61 |
| ▸ | NPC1 | O15118 | 9/20 | 0.61 |
| ▸ | RAB9A | P51151 | 9/20 | 0.61 |
| ▸ | IKBKE | Q14164 | 3/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.61 |
| ▸ | PKM | P14618 | 2/20 | 0.61 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.61 |
| ▸ | TTR | P02766 | 1/20 | 0.61 |
| ▸ | GAA | P10253 | 1/20 | 0.61 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.61 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.61 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.61 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.61 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.61 |
| ▸ | RXFP1 | Q9HBX9 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL10989695 | 0.89 | NPC1 (0.54) | TBK1NPC1RAB9AIKBKEKDM4E | |
| SCHEMBL10992854 | 0.88 | NPC1 (0.52) | TBK1NPC1RAB9AIKBKEKDM4E | |
| SCHEMBL10995250 | 0.88 | NPC1 (0.59) | TBK1NPC1RAB9AIKBKEKDM4E | |
| SCHEMBL10992998 | 0.87 | RAB9A (0.58) | TBK1NPC1RAB9AIKBKEKDM4E | |
| SCHEMBL10998062 | 0.86 | RAB9A (0.69) | TBK1NPC1RAB9AIKBKEKDM4E | |
| SCHEMBL10994012 | 0.86 | NPC1 (0.50) | TBK1NPC1RAB9AIKBKEKDM4E | |
| SCHEMBL16210853 | 0.84 | TBK1 (0.78) | TBK1NPC1RAB9AIKBKEKDM4E | |
| SCHEMBL11102182 | 0.83 | NPC1 (0.61) | TBK1NPC1RAB9AIKBKEKDM4E | |
| SCHEMBL17533970 | 0.78 | TBK1 (0.54) | TBK1NPC1RAB9AIKBKEKDM4E | |
| SCHEMBL19180556 | 0.77 | TBK1 (0.72) | TBK1NPC1RAB9AIKBKEKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-4539326-A | REACTION OF KETOBENZOPYRAN CARBONITRILE AND KETODICARBOXYLIC ESTER | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1985-09-03 | — | — | US | claimed |
| EP-0102175-A1 | 5-Oxo-5H-(1)benzopyrano(2,3-b)pyridine derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1984-03-07 | — | — | EP | claimed |
| US-4539326-A | REACTION OF KETOBENZOPYRAN CARBONITRILE AND KETODICARBOXYLIC ESTER | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1985-09-03 | — | — | US | disclosed |