Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 3/20 | 0.55 |
| ▸ | BRD4 | O60885 | 11/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.46 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL12561181 | 0.79 | PKM (0.58) | PKMBRD4ALDH1A1KDM4EMEN1 | |
| SCHEMBL12561180 | 0.78 | PKM (0.57) | PKMBRD4ALDH1A1KDM4EMEN1 | |
| SCHEMBL9290407 | 0.78 | PKM (0.57) | PKMBRD4ALDH1A1KDM4EMEN1 | |
| SCHEMBL9290413 | 0.78 | PKM (0.57) | PKMBRD4ALDH1A1KDM4EMEN1 | |
| SCHEMBL9078889 | 0.78 | USP2 (0.76) | PKMBRD4ALDH1A1KDM4EMEN1 | |
| SCHEMBL30517121 | 0.78 | PKM (0.57) | PKMBRD4ALDH1A1KDM4EMEN1 | |
| SCHEMBL31735710 | 0.76 | PKM (0.71) | PKMBRD4ALDH1A1KDM4EUSP2 | |
| SCHEMBL9290441 | 0.76 | PKM (0.52) | PKMBRD4ALDH1A1KDM4EMEN1 | |
| SCHEMBL12601548 | 0.75 | PKM (0.58) | PKMBRD4ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL9290421 | 0.75 | KDM4E (0.68) | PKMBRD4ALDH1A1KDM4EMEN1 |
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-2695930-B1 | POLYMERIZABLE LIQUID CRYSTAL COMPOSITION, POLARIZED LIGHT-EMITTING COATING MATERIAL, NOVEL NAPHTHOLACTAM DERIVATIVE, NOVEL COUMARIN DERIVATIVE, NOVEL NILE RED DERIVATIVE, AND NOVEL ANTHRACENE DERIVATIVE | DAINIPPON INK & CHEMICALS (JP) | 2019-09-11 | — | — | EP | disclosed |