Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 5/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | CDC7 | O00311 | 2/20 | 0.37 |
| ▸ | PLK4 | O00444 | 2/20 | 0.37 |
| ▸ | DYRK3 | O43781 | 2/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.37 |
| ▸ | PRKD3 | O94806 | 2/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.37 |
| ▸ | INSR | P06213 | 2/20 | 0.37 |
| ▸ | CDK1 | P06493 | 2/20 | 0.37 |
| ▸ | ROS1 | P08922 | 2/20 | 0.37 |
| ▸ | PIM1 | P11309 | 2/20 | 0.37 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.37 |
| ▸ | PRKACA | P17612 | 2/20 | 0.37 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.37 |
| ▸ | CDK2 | P24941 | 2/20 | 0.37 |
| ▸ | FLT4 | P35916 | 2/20 | 0.37 |
| ▸ | KDR | P35968 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11797546 | 0.75 | TSHR (0.44) | TDP1TSHRALDH1A1MAPTGAA | |
| SCHEMBL2889156 | 0.71 | TSHR (0.53) | TDP1TSHRALDH1A1SMN1; SMN2L3MBTL1 | |
| SCHEMBL5410548 | 0.70 | LIMK1 (0.45) | TSHRALDH1A1CDC7PLK4DYRK3 | |
| SCHEMBL5120287 | 0.70 | TDP1 (0.46) | TDP1TSHRALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL1117860 | 0.69 | TSHR (0.50) | TDP1TSHRALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL3828432 | 0.69 | LIMK1 (0.47) | TSHRALDH1A1MAPTCDC7PLK4 | |
| SCHEMBL30616318 | 0.67 | TSHR (0.47) | TDP1TSHRALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL28247578 | 0.67 | L3MBTL1 (0.44) | TDP1TSHRALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL7103494 | 0.67 | TDP1 (0.39) | TDP1TSHRALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL31440618 | 0.67 | BCAT2 (0.39) | ALDH1A1CDC7PLK4DYRK3ROCK2 |
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-2004092181-A9 | HETEROCYCLIC MCHR1 ANTAGONISTS | SMITHKLINE BEECHAM CORP (US) | 2005-01-27 | — | — | WO | disclosed |