Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL17468978 | 0.87 | MEN1 (0.34) | MEN1NPC1RAB9AKMT2A | |
| SCHEMBL17468974 | 0.84 | — | — | |
| SCHEMBL17469132 | 0.75 | SOAT1 (0.32) | — | |
| SCHEMBL17469133 | 0.72 | OPRM1 (0.30) | — | |
| SCHEMBL13467944 | 0.66 | ATM (0.42) | ATMTSHRMEN1RAB9AKMT2A | |
| SCHEMBL9206727 | 0.65 | — | — | |
| SCHEMBL1538030 | 0.63 | ATM (0.43) | ATMTSHRMEN1KMT2A | |
| SCHEMBL15482805 | 0.63 | ATM (0.33) | ATM | |
| SCHEMBL9856940 | 0.63 | ALDH1A1 (0.46) | ATMTSHRMEN1KMT2A | |
| SCHEMBL3472392 | 0.62 | ATM (0.42) | ATMTSHRMEN1RAB9AKMT2A |
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-2016012362-A1 | SUBSTITUTED CYANO CYCLOALKYL PENTA-2,4-DIENES, CYANO CYCLOALKYL PENT-2-EN-4-YNES, CYANO HETEROCYCLYL PENTA-2,4-DIENES AND CYANO HETEROCYCLYL PENT-2-EN-4-YNES AS ACTIVE SUBSTANCES AGAINST ABIOTIC PLANT STRESS | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2016-01-28 | — | — | WO | disclosed |