Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 4/20 | 0.66 |
| ▸ | XDH | P47989 | 3/20 | 0.61 |
| ▸ | PFKFB2 | O60825 | 3/20 | 0.53 |
| ▸ | PFKFB1 | P16118 | 3/20 | 0.53 |
| ▸ | PFKFB3 | Q16875 | 3/20 | 0.53 |
| ▸ | CA12 | O43570 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL28429322 | 0.92 | XDH (0.72) | CA9XDH | |
| SCHEMBL28429336 | 0.87 | XDH (0.65) | CA9XDH | |
| SCHEMBL28432916 | 0.87 | XDH (0.65) | CA9XDH | |
| SCHEMBL29940470 | 0.87 | CA9 (0.69) | CA9XDHPFKFB2PFKFB1PFKFB3 | |
| SCHEMBL29940925 | 0.87 | CA9 (0.55) | CA9XDHPFKFB2PFKFB1PFKFB3 | |
| SCHEMBL28426663 | 0.87 | CA9 (0.55) | CA9XDHPFKFB2PFKFB1PFKFB3 | |
| SCHEMBL28429359 | 0.87 | CA9 (0.69) | CA9XDHPFKFB2PFKFB1PFKFB3 | |
| SCHEMBL28432409 | 0.85 | XDH (0.67) | CA9XDHPFKFB2PFKFB1PFKFB3 | |
| SCHEMBL28427099 | 0.85 | XDH (0.61) | CA9XDHCA12 | |
| SCHEMBL28430820 | 0.83 | XDH (0.63) | CA9XDH |
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-111072634-A | 1-substituted-3-substituted-5-substituted amide-1H-indole compound and preparation method and application thereof | 中国医科大学 | 2020-04-28 | — | — | CN | claimed |
| CN-111072634-B | 1-substituted-3-substituted-5-substituted amide-1H-indole compound and preparation method and application thereof | 中国医科大学 | 2022-07-22 | — | — | CN | disclosed |
| CN-111072634-A | 1-substituted-3-substituted-5-substituted amide-1H-indole compound and preparation method and application thereof | 中国医科大学 | 2020-04-28 | — | — | CN | disclosed |