Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | PKM | P14618 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.33 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.33 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.33 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.33 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL23967944 | 0.72 | ALDH1A1 (0.40) | ALDH1A1LMNASMN1; SMN2CYP2D6MAPT | |
| SCHEMBL2049579 | 0.64 | ALDH1A1 (0.66) | ALDH1A1LMNASMN1; SMN2HDAC3HDAC4 | |
| SCHEMBL29484678 | 0.63 | LMNA (0.53) | ALDH1A1LMNASMN1; SMN2HSP90AA1CYP1A2 | |
| SCHEMBL1928791 | 0.61 | ACP3 (0.43) | ALDH1A1LMNACYP1A2HSD17B10MEN1 | |
| SCHEMBL6722066 | 0.61 | ESR1 (0.41) | ALDH1A1LMNAHSD17B10POLBMAPT | |
| Water SCHEMBL8545817 | 0.60 | ACP3 (0.42) | ALDH1A1LMNACYP1A2HSD17B10MAPT | |
| SCHEMBL28209564 | 0.60 | AKR1C3 (0.47) | ALDH1A1LMNASMN1; SMN2HSD17B10MAPT | |
| SCHEMBL5696122 | 0.59 | LMNA (0.39) | ALDH1A1LMNASMN1; SMN2ATMCYP1A2 | |
| SCHEMBL5354641 | 0.59 | LMNA (0.44) | ALDH1A1LMNASMN1; SMN2ATMCYP1A2 | |
| SCHEMBL3447542 | 0.59 | LMNA (0.44) | ALDH1A1LMNASMN1; SMN2ATMCYP1A2 |
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-3903581-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 I | BASF SE (DE) | 2021-11-03 | — | — | EP | disclosed |