Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | DDX3X | O00571 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CRHBP | P24387 | 2/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | SCN1A | P35498 | 1/20 | 0.36 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.36 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | NLRP3 | Q96P20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5696122 | 0.81 | LMNA (0.39) | ALDH1A1LMNAMAPK1GAASMN1; SMN2 | |
| SCHEMBL4955315 | 0.81 | MAPK1 (0.43) | ALDH1A1LMNAMAPK1GAAHTT | |
| SCHEMBL3693317 | 0.80 | LMNA (0.38) | ALDH1A1LMNAMAPK1GAAHTT | |
| SCHEMBL25269621 | 0.79 | GAA (0.43) | ALDH1A1MAPK1GAAHTTCYP3A4 | |
| SCHEMBL28718756 | 0.77 | ESR1 (0.42) | ALDH1A1LMNAMAPK1GAAHTT | |
| SCHEMBL29484678 | 0.76 | LMNA (0.53) | ALDH1A1LMNAMAPK1CRHBPCRHR2 | |
| SCHEMBL23977977 | 0.72 | ALDH1A1 (0.37) | ALDH1A1LMNACRHBPCRHR2HTT | |
| SCHEMBL8284261 | 0.70 | ADRA2A (0.37) | LMNAMAPK1GAAPGRESR1 | |
| SCHEMBL2049579 | 0.70 | ALDH1A1 (0.66) | ALDH1A1LMNACRHBPCRHR2GAA | |
| SCHEMBL10839956 | 0.70 | CYP1A2 (0.50) | ALDH1A1GAACYP3A4HPGDMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3903584-A1 | USE OF STROBILURIN TYPE COMPOUNDS FOR COMBATING PHYTOPATHOGENIC FUNGI CONTAINING AN AMINO ACID SUBSTITUTION F129L IN THE MITOCHONDRIAL CYTOCHROME B PROTEIN CONFERRING RESISTANCE TO QO INHIBITORS IV | BASF SE (DE) | 2021-11-03 | — | — | EP | disclosed |