Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.40 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | TDO2 | P48775 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | ACP3 | P15309 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9557198 | 0.91 | TAAR1 (0.45) | CNR2IDO1TDO2MEN1KMT2A | |
| SCHEMBL1343597 | 0.84 | ACP3 (0.44) | CYP19A1MEN1KMT2AACP3ALDH1A1 | |
| SCHEMBL31447688 | 0.83 | LMNA (0.42) | CYP19A1MEN1KMT2ATAAR1ALDH1A1 | |
| SCHEMBL2628022 | 0.82 | CNR2 (0.39) | CNR2IDO1TDO2 | |
| SCHEMBL31447615 | 0.82 | GAA (0.41) | CYP19A1MEN1KMT2ATAAR1ACP3 | |
| SCHEMBL17996055 | 0.80 | ACP3 (0.42) | CYP19A1MEN1KMT2AACP3ALDH1A1 | |
| SCHEMBL7661916 | 0.78 | CASR (0.50) | KMT2ATAAR1GPR52 | |
| SCHEMBL30849676 | 0.76 | CNR2 (0.49) | CNR2OPRM1OPRL1IDO1TDO2 | |
| SCHEMBL31447616 | 0.76 | IDO1 (0.56) | IDO1TDO2MEN1KMT2ATAAR1 | |
| SCHEMBL29061977 | 0.76 | AOC3 (0.40) | CNR2IDO1TDO2KMT2AMAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0214793-B1 | (2-CYANO-2-ARYLETHYL)PYRIDINES, THEIR PREPARATION AND USE AS FUNGICIDES | ROHM AND HAAS COMPANY (US) | 1990-06-13 | — | — | EP | disclosed |
| US-4933339-A | PHYTOPATHOGENS | ROHM AND HAAS COMPANY (US) | 1990-06-12 | — | — | US | disclosed |
| EP-0214793-A1 | (2-Cyano-2-arylethyl)pyridines, their preparation and use as fungicides | ROHM AND HAAS COMPANY (US) | 1987-03-18 | — | — | EP | disclosed |