Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.36 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.31 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.31 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | CNR2 | P34972 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23265369 | 0.91 | ALDH1A1 (0.36) | ALDH1A1MEN1KMT2ASMN1; SMN2GRIN2B | |
| SCHEMBL23265498 | 0.90 | ABCB1 (0.34) | ABCB1ABCG2ALDH1A1MEN1KMT2A | |
| SCHEMBL21295278 | 0.90 | ABCB1 (0.37) | ABCB1ABCG2ALDH1A1MEN1KMT2A | |
| SCHEMBL29433011 | 0.90 | ABCB1 (0.37) | ABCB1ABCG2ALDH1A1MEN1KMT2A | |
| SCHEMBL23266054 | 0.87 | ABCB1 (0.37) | ABCB1ABCG2ALDH1A1MEN1KMT2A | |
| SCHEMBL23265459 | 0.87 | ALDH1A1 (0.46) | ABCB1ABCG2ALDH1A1MEN1KMT2A | |
| SCHEMBL23265495 | 0.87 | KDM4E (0.34) | ABCB1ABCG2ALDH1A1MEN1KMT2A | |
| SCHEMBL23265363 | 0.86 | ABCB1 (0.34) | ABCB1ABCG2ALDH1A1MEN1KMT2A | |
| SCHEMBL23265374 | 0.86 | ABCB1 (0.35) | ABCB1ABCG2ALDH1A1MEN1KMT2A | |
| SCHEMBL23265365 | 0.86 | ABCB1 (0.35) | ABCB1ABCG2ALDH1A1MEN1KMT2A |
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-2021074309-A1 | 1-(3-QUINOLYL)-3,4-DIHYDROISOQUINOLINE DERIVATIVES AS FUNGICIDES FOR COMBATING SPECIFIC PHYTOPATHOGENS | SYNGENTA CROP PROTECTION AG (CH) | 2021-04-22 | — | — | WO | disclosed |