Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K1 | Q92918 | 8/20 | 0.38 |
| ▸ | PRKCI | P41743 | 1/20 | 0.38 |
| ▸ | ITK | Q08881 | 1/20 | 0.37 |
| ▸ | NAMPT | P43490 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | IKBKB | O14920 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.35 |
| ▸ | JAK1 | P23458 | 1/20 | 0.35 |
| ▸ | TYK2 | P29597 | 1/20 | 0.35 |
| ▸ | JAK3 | P52333 | 1/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29137063 | 1.00 | MAP4K1 (0.38) | MAP4K1PRKCIITKNAMPTALDH1A1 | |
| SCHEMBL29879691 | 0.83 | MAP4K1 (0.43) | MAP4K1PRKCINAMPTALDH1A1LMNA | |
| SCHEMBL24738437 | 0.83 | MAP4K1 (0.43) | MAP4K1PRKCINAMPTALDH1A1LMNA | |
| SCHEMBL29137062 | 0.75 | GLA (0.41) | MAP4K1ITKLMNATSHRHDAC3 | |
| SCHEMBL29137061 | 0.75 | GLA (0.41) | MAP4K1ITKLMNATSHRHDAC3 | |
| SCHEMBL30715078 | 0.74 | CCR1 (0.40) | ALDH1A1LMNASMN1; SMN2KDM4ECYP3A4 | |
| SCHEMBL29940136 | 0.72 | TYK2 (0.41) | MAP4K1ALDH1A1LMNASMN1; SMN2TYK2 | |
| SCHEMBL24737858 | 0.72 | TYK2 (0.41) | MAP4K1ALDH1A1LMNASMN1; SMN2TYK2 | |
| SCHEMBL29137012 | 0.72 | MAPK14 (0.39) | MAP4K1ITKALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL29137009 | 0.72 | MAPK14 (0.39) | MAP4K1ITKALDH1A1LMNASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117355521-A | Heteroaryl inhibitors of plasma kallikrein | 武田药品工业株式会社 | 2024-01-05 | — | — | CN | disclosed |