Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | HPGD | P15428 | 2/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.30 |
| ▸ | BRCA1 | P38398 | 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 | |
|---|---|---|---|---|
| SCHEMBL21021656 | 0.92 | CNR1 (0.34) | NPSR1CNR1CNR2ALDH1A1GAA | |
| SCHEMBL21022090 | 0.85 | CNR2 (0.40) | NPSR1TSHRMAPK1ATMTDP1 | |
| SCHEMBL20076455 | 0.82 | SLC5A2 (0.34) | NPSR1SLC5A1SLC5A2 | |
| SCHEMBL21022302 | 0.80 | SLC5A2 (0.32) | CNR1CNR2GAAMAPTSLC5A1 | |
| SCHEMBL21021542 | 0.78 | SLC9A1 (0.37) | ATMSLC5A1SLC5A2 | |
| SCHEMBL20076684 | 0.76 | SLC9A1 (0.38) | TSHRL3MBTL1KMT2ASLC5A1SLC5A2 | |
| SCHEMBL21021657 | 0.75 | KDM1A (0.41) | CYP3A4KDM4EALDH1A1MEN1MAPT | |
| SCHEMBL21021762 | 0.75 | SLC9A1 (0.32) | — | |
| SCHEMBL20076857 | 0.75 | IDH1 (0.33) | — | |
| SCHEMBL20076432 | 0.74 | MEN1 (0.40) | CYP3A4KDM4EALDH1A1HPGDGAA |
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-2018071327-A1 | MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO | DOW AGROSCIENCES LLC (US) | 2018-04-19 | — | — | WO | disclosed |