Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.48 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.47 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.46 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | HTR2B | P41595 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.44 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | AGXT | P21549 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | SCN4A | P35499 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL21086544 | 0.87 | TDP1 (0.44) | CYP11B1CYP11B2TDP1LMNACYP2D6 | |
| SCHEMBL12301147 | 0.85 | TDP1 (0.47) | SCN8ACYP11B1CYP11B2TDP1LMNA | |
| SCHEMBL12301124 | 0.84 | MRGPRX4 (0.58) | MRGPRX4TDP1LMNAIDO1AGXT | |
| SCHEMBL12301146 | 0.81 | SCN4A (0.53) | CYP11B1CYP11B2TDP1LMNAIDO1 | |
| SCHEMBL12301162 | 0.75 | TDP1 (0.69) | TDP1LMNACYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL24965971 | 0.74 | TAAR1 (0.57) | TAAR1SLC6A4IDO1AGXTMAOB | |
| SCHEMBL28648032 | 0.74 | TAAR1 (0.61) | TAAR1SLC6A4IDO1AGXTMAOB | |
| SCHEMBL5224566 | 0.74 | MAPK14 (0.47) | CYP11B1CYP11B2TAAR1HTR2CSLC6A4 | |
| SCHEMBL13154286 | 0.73 | RXRA (0.51) | POLBMRGPRX4TDP1LMNAIDO1 | |
| SCHEMBL16191821 | 0.73 | TAAR1 (0.52) | SCN8ATAAR1SLC6A4IDO1AGXT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2968440-B1 | CYTOTOXIC AND ANTI-MITOTIC COMPOUNDS, AND METHODS OF USING THE SAME | ZYMEWORKS INC (CA) | 2019-06-05 | — | — | EP | disclosed |