Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 1/20 | 0.54 |
| ▸ | MKNK1 | Q9BUB5 | 7/20 | 0.51 |
| ▸ | MKNK2 | Q9HBH9 | 7/20 | 0.51 |
| ▸ | F7 | P08709 | 1/20 | 0.46 |
| ▸ | F3 | P13726 | 1/20 | 0.46 |
| ▸ | SARM1 | Q6SZW1 | 1/20 | 0.46 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.46 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.46 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.46 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.46 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.46 |
| ▸ | SIRT4 | Q9Y6E7 | 1/20 | 0.46 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | ATR | Q13535 | 1/20 | 0.43 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.43 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28815566 | 0.84 | MKNK1 (0.51) | IKBKBMKNK1MKNK2F7F3 | |
| SCHEMBL29504504 | 0.84 | MKNK1 (0.51) | IKBKBMKNK1MKNK2F7F3 | |
| SCHEMBL5320803 | 0.83 | CYP3A4 (0.55) | IKBKBMKNK1MKNK2F7F3 | |
| SCHEMBL30165669 | 0.79 | MKNK1 (0.56) | IKBKBMKNK1MKNK2F7F3 | |
| SCHEMBL2572631 | 0.79 | MKNK1 (0.56) | IKBKBMKNK1MKNK2F7F3 | |
| SCHEMBL29594571 | 0.79 | MKNK1 (0.56) | IKBKBMKNK1MKNK2F7F3 | |
| SCHEMBL29505512 | 0.78 | SCN9A (0.59) | IKBKBMKNK1MKNK2F7F3 | |
| SCHEMBL28324757 | 0.78 | SCN9A (0.59) | IKBKBMKNK1MKNK2F7F3 | |
| SCHEMBL29961476 | 0.77 | MKNK1 (0.54) | IKBKBMKNK1MKNK2F7F3 | |
| SCHEMBL28610157 | 0.77 | GRK2 (0.52) | IKBKBMKNK1MKNK2CYP3A4ATR |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105732675-A | Novel trinuclear functional complex and preparation method | 河南工程学院 | 2016-07-06 | — | — | CN | claimed |
| CN-105732674-A | Novel one-dimensional functional complex and preparation method | 河南工程学院 | 2016-07-06 | — | — | CN | claimed |
| CN-105732672-A | Novel double-core functional complex and preparation method | 河南工程学院 | 2016-07-06 | — | — | CN | claimed |
| CN-105732673-A | Novel one-dimensional double-chain functional complex and preparation method thereof | 河南工程学院 | 2016-07-06 | — | — | CN | claimed |
| CN-105732675-A | Novel trinuclear functional complex and preparation method | 河南工程学院 | 2016-07-06 | — | — | CN | disclosed |
| CN-105732674-A | Novel one-dimensional functional complex and preparation method | 河南工程学院 | 2016-07-06 | — | — | CN | disclosed |
| CN-105732672-A | Novel double-core functional complex and preparation method | 河南工程学院 | 2016-07-06 | — | — | CN | disclosed |
| CN-105732673-A | Novel one-dimensional double-chain functional complex and preparation method thereof | 河南工程学院 | 2016-07-06 | — | — | CN | disclosed |