Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.40 |
| ▸ | SRC | P12931 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MMP8 | P22894 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | CTSL | P07711 | 1/20 | 0.34 |
| ▸ | CTSS | P25774 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL18978225 | 0.86 | SRC (0.41) | ALDH1A1AKR1C3AKR1C1SRCKMT2A | |
| SCHEMBL11505425 | 0.82 | KMT2A (0.42) | ALDH1A1AKR1C3AKR1C1KMT2ATDP1 | |
| SCHEMBL18978596 | 0.82 | SRC (0.38) | ALDH1A1AKR1C3AKR1C1SRCKMT2A | |
| SCHEMBL2835326 | 0.82 | ALDH1A1 (0.50) | ALDH1A1AKR1C3AKR1C1KMT2ATDP1 | |
| SCHEMBL7699172 | 0.82 | ALDH1A1 (0.50) | ALDH1A1AKR1C3AKR1C1KMT2ATDP1 | |
| SCHEMBL8965019 | 0.80 | KLK7 (0.46) | ALDH1A1TDP1TSHRLMNAHTT | |
| SCHEMBL18978602 | 0.80 | SRC (0.36) | ALDH1A1AKR1C3AKR1C1SRCKMT2A | |
| SCHEMBL5320869 | 0.79 | LMNA (0.47) | ALDH1A1AKR1C3AKR1C1KMT2ATDP1 | |
| SCHEMBL11020054 | 0.78 | KMT2A (0.46) | ALDH1A1AKR1C3AKR1C1KMT2ATDP1 | |
| SCHEMBL11020156 | 0.78 | KMT2A (0.46) | ALDH1A1AKR1C3AKR1C1KMT2ATDP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017097870-A1 | SUBSTITUTED MALONIC ACID AMIDES AS INSECTICIDES | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2017-06-15 | — | — | WO | disclosed |