Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | PPARA | Q07869 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | GUSB | P08236 | 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 | |
|---|---|---|---|---|
| SCHEMBL12896367 | 0.78 | TEAD1 (0.44) | TAAR1SLC6A2SLC6A4SLC6A3MAOB | |
| SCHEMBL21610394 | 0.78 | MAOB (0.43) | TAAR1SLC6A2SLC6A4SLC6A3MAOB | |
| SCHEMBL12896360 | 0.78 | TEAD1 (0.44) | TAAR1SLC6A2SLC6A4SLC6A3MAOB | |
| SCHEMBL30866950 | 0.73 | MAOB (0.52) | MAOBPPARGPPARA | |
| SCHEMBL18010262 | 0.69 | GSK3B (0.42) | SLC6A2SLC6A4SLC6A3MAOBTSHR | |
| SCHEMBL14880239 | 0.69 | MAOB (0.52) | MAOBTSHRPPARGPPARAPTPN1 | |
| SCHEMBL3686131 | 0.68 | SLC6A2 (0.39) | TAAR1SLC6A2SLC6A4SLC6A3HTR2A | |
| SCHEMBL12897093 | 0.67 | CYP19A1 (0.35) | MAOBPPARGPPARAPTPN1 | |
| SCHEMBL12897094 | 0.67 | CYP19A1 (0.35) | MAOBPPARGPPARAPTPN1 | |
| Clominorex SCHEMBL121090 | 0.67 | TAAR1 (0.46) | TAAR1SLC6A2SLC6A4SLC6A3NOS3 |
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-2020002083-A1 | SUBSTITUTED HETEROCYCLIC PYRROLONES AND SALTS THEREOF AND USE THEREOF AS HERBICIDAL AGENTS | BAYER AKTIENGESELLSCHAFT (DE) | 2020-01-02 | — | — | WO | disclosed |