Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 3/20 | 0.78 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.78 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.78 |
| ▸ | TSHR | P16473 | 2/20 | 0.78 |
| ▸ | MAPT | P10636 | 2/20 | 0.63 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.43 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.43 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.43 |
| ▸ | PLK1 | P53350 | 1/20 | 0.39 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.38 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.38 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL11764203 | 0.89 | MAPK1 (0.80) | MAPK1CYP3A4TDP1TSHRMAPT | |
| Trifluralin SCHEMBL8409474 | 0.88 | TDP1 (1.00) | MAPK1CYP3A4TDP1TSHRMAPT | |
| Trifluralin SCHEMBL21994 | 0.88 | TDP1 (1.00) | MAPK1CYP3A4TDP1TSHRMAPT | |
| SCHEMBL11204357 | 0.85 | TDP1 (0.89) | MAPK1CYP3A4TDP1TSHRMAPT | |
| SCHEMBL11202092 | 0.83 | CYP3A4 (0.89) | MAPK1CYP3A4TDP1TSHRMAPT | |
| SCHEMBL11761204 | 0.82 | MAPK1 (0.70) | MAPK1CYP3A4TDP1TSHRMAPT | |
| SCHEMBL11810287 | 0.82 | CYP3A4 (0.86) | MAPK1CYP3A4TDP1TSHRMAPT | |
| Fluchloralin SCHEMBL54746 | 0.82 | CYP3A4 (0.86) | MAPK1CYP3A4TDP1TSHRMAPT | |
| Fluchloralin SCHEMBL8534586 | 0.82 | CYP3A4 (0.86) | MAPK1CYP3A4TDP1TSHRMAPT | |
| SCHEMBL11764588 | 0.81 | MAPK1 (0.73) | MAPK1CYP3A4TDP1TSHRMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-4042628-A | HERBICIDES | BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) | 1977-08-16 | — | — | US | disclosed |