Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | GPR39 | O43194 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL24310188 | 0.80 | MAPK1 (0.50) | MAPK1TDP1MAPTALDH1A1GPR39 | |
| SCHEMBL24309752 | 0.78 | MAPK1 (0.57) | MAPK1TDP1MAPTALDH1A1GPR39 | |
| SCHEMBL24309688 | 0.74 | MAPK1 (0.46) | MAPK1TDP1MAPTALDH1A1GPR39 | |
| SCHEMBL24310176 | 0.73 | MAPK1 (0.51) | MAPK1TDP1MAPTALDH1A1GPR39 | |
| SCHEMBL24309653 | 0.73 | MAPK1 (0.51) | MAPK1TDP1MAPTALDH1A1GPR39 | |
| SCHEMBL26812998 | 0.72 | TDP1 (0.54) | MAPK1TDP1MAPTALDH1A1GPR39 | |
| SCHEMBL26812905 | 0.72 | MAPK1 (0.50) | MAPK1TDP1MAPTALDH1A1GPR39 | |
| SCHEMBL26806813 | 0.72 | MAPT (0.61) | MAPK1TDP1MAPTALDH1A1GPR39 | |
| SCHEMBL26812929 | 0.72 | MAPK1 (0.52) | MAPK1TDP1MAPTALDH1A1GPR39 | |
| SCHEMBL24310546 | 0.71 | MAPK1 (0.49) | MAPK1TDP1MAPTALDH1A1GPR39 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022076627-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |