Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | PDE7A | Q13946 | 5/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.35 |
| ▸ | ALPL | P05186 | 1/20 | 0.35 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.35 |
| ▸ | XIAP | P98170 | 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 | |
|---|---|---|---|---|
| SCHEMBL10520167 | 0.84 | CYP3A4 (0.52) | CYP3A4TSHRMAPK1MAPTPDE7A | |
| SCHEMBL10517679 | 0.79 | CYP3A4 (0.46) | CYP3A4TSHRMAPK1MAPTPDE7A | |
| SCHEMBL10522538 | 0.78 | CYP3A4 (0.45) | CYP3A4TSHRMAPK1MAPTPDE7A | |
| SCHEMBL10560991 | 0.78 | TSHR (0.54) | CYP3A4TSHRMAPK1MAPTPDE7A | |
| SCHEMBL10521296 | 0.76 | MAPT (0.51) | MAPK1MAPTPDE7AHTTMEN1 | |
| SCHEMBL4394098 | 0.76 | MAPT (0.65) | CYP3A4TSHRMAPK1MAPTPDE7A | |
| SCHEMBL10519453 | 0.74 | CYP3A4 (0.45) | CYP3A4TSHRMAPK1MAPTPDE7A | |
| SCHEMBL10518031 | 0.74 | CYP3A4 (0.41) | CYP3A4TSHRMAPK1MAPTPDE7A | |
| SCHEMBL10514565 | 0.72 | HTT (0.49) | CYP3A4TSHRMAPK1MAPTPDE7A | |
| SCHEMBL9485453 | 0.68 | CYP3A4 (1.00) | CYP3A4TSHRMAPK1MAPTPDE7A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4797146-A | INSECTICIDES, FUNGICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1989-01-10 | — | — | US | disclosed |
| EP-0226885-A1 | Pyrimidylmercapto-acylanilides | BAYER AG (DE) | 1987-07-01 | — | — | EP | disclosed |