Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | PDE7A | Q13946 | 4/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11896187 | 0.79 | CYP3A4 (0.48) | CYP3A4TSHRALDH1A1ALOX15SMN1; SMN2 | |
| SCHEMBL7453199 | 0.78 | CYP3A4 (0.56) | CYP3A4TSHRALDH1A1ALOX15SMN1; SMN2 | |
| SCHEMBL13816918 | 0.77 | ITGB2 (0.46) | CYP3A4TSHRALDH1A1ALOX15TDP1 | |
| SCHEMBL13816982 | 0.75 | CCR2 (0.36) | CYP3A4ALDH1A1ALOX15SMN1; SMN2HPGD | |
| SCHEMBL3783594 | 0.74 | CYP3A4 (0.52) | CYP3A4TSHRALDH1A1ALOX15SMN1; SMN2 | |
| SCHEMBL30422063 | 0.74 | CYP3A4 (0.52) | CYP3A4TSHRALDH1A1ALOX15SMN1; SMN2 | |
| SCHEMBL19631183 | 0.73 | CYP3A4 (0.46) | CYP3A4TSHRALDH1A1ALOX15SMN1; SMN2 | |
| SCHEMBL27028671 | 0.73 | PDE7A (0.34) | CYP3A4TSHRALDH1A1ALOX15SMN1; SMN2 | |
| SCHEMBL10738091 | 0.73 | TSHR (0.40) | CYP3A4TSHRALDH1A1ALOX15SMN1; SMN2 | |
| SCHEMBL13515980 | 0.72 | LMNA (0.32) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0008435-B1 | SUBSTITUTED N-PHENYL-N'-BENZOYL-THIOUREAS, THEIR PREPARATION AND THEIR USE AS PESTICIDES | BAYER AG (DE) | 1982-05-12 | — | — | EP | disclosed |
| US-4276310-A | ARTHROPODICIDES, FUNGICIDES, BACTERICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1981-06-30 | — | — | US | disclosed |
| EP-0008435-A2 | Substituted N-phenyl-N'-benzoyl-thioureas, their preparation and their use as pesticides | BAYER AG (DE) | 1980-03-05 | — | — | EP | disclosed |