Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | PKM | P14618 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | IDH2 | P48735 | 5/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | PKLR | P30613 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6248665 | 0.89 | EPHX2 (0.47) | KDM4EPKMHPGDUSP2CYP1A2 | |
| SCHEMBL5142356 | 0.80 | EPHX2 (0.57) | KDM4EPKMHPGDUSP2CYP1A2 | |
| SCHEMBL5142362 | 0.80 | EPHX2 (0.57) | KDM4EPKMHPGDUSP2CYP1A2 | |
| SCHEMBL5142358 | 0.80 | EPHX2 (0.57) | KDM4EPKMHPGDUSP2CYP1A2 | |
| SCHEMBL6248700 | 0.79 | KMT2A (0.36) | KDM4EMAPTMAPK1KMT2AALDH1A1 | |
| SCHEMBL6265295 | 0.77 | BRAF (0.38) | CYP1A2KMT2AALDH1A1HSD17B10 | |
| SCHEMBL6265380 | 0.73 | LMNA (0.41) | KDM4EHPGDMAPTKMT2AALDH1A1 | |
| SCHEMBL6247880 | 0.71 | RECQL (0.43) | PKMHPGDMAPTKMT2AALDH1A1 | |
| SCHEMBL6246748 | 0.70 | GRK2 (0.40) | KDM4EPKMCYP1A2MAPTCYP2C9 | |
| SCHEMBL6248564 | 0.70 | MAPT (0.43) | PKMMAPTPKLR |
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-2005037196-A2 | SUBSTITUTED 2-ARYLMETHYLENE-N-ARYL-N'-ARYL-MALONAMIDES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS | CYTOVIA, INC. (US) | 2005-04-28 | — | — | WO | claimed |