Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | HCRTR1 | O43613 | 3/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.37 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | PRKCI | P41743 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | DAO | P14920 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18378183 | 0.83 | ALDH1A1 (0.42) | ALDH1A1LMNAHCRTR1HCRTR2FOLH1 | |
| SCHEMBL9046425 | 0.83 | ALDH1A1 (0.42) | ALDH1A1LMNAHCRTR1HCRTR2FOLH1 | |
| SCHEMBL21319068 | 0.83 | GABRA1 (0.44) | ALDH1A1LMNAFOLH1HTTTP53 | |
| SCHEMBL10804965 | 0.82 | KMT2A (0.39) | ALDH1A1LMNAHCRTR1HCRTR2FOLH1 | |
| SCHEMBL2491587 | 0.80 | FOLH1 (0.41) | ALDH1A1LMNAHCRTR1HCRTR2FOLH1 | |
| Water SCHEMBL28035664 | 0.80 | KMT2A (0.38) | ALDH1A1LMNAHCRTR1HCRTR2FOLH1 | |
| SCHEMBL712790 | 0.79 | ALDH1A1 (0.40) | ALDH1A1LMNAHCRTR1HCRTR2FOLH1 | |
| SCHEMBL30628269 | 0.79 | ALDH1A1 (0.47) | ALDH1A1LMNAHCRTR1HCRTR2FOLH1 | |
| SCHEMBL2125820 | 0.79 | ALDH1A1 (0.47) | ALDH1A1LMNAHCRTR1HCRTR2FOLH1 | |
| SCHEMBL29590143 | 0.79 | ALDH1A1 (0.40) | ALDH1A1LMNAHCRTR1HCRTR2FOLH1 |
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-3903583-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 III | BASF SE (DE) | 2021-11-03 | — | — | EP | disclosed |