Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 2/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.31 |
| ▸ | PDK1 | Q15118 | 2/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.31 |
| ▸ | PDK3 | Q15120 | 2/20 | 0.31 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.31 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.31 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21683296 | 0.77 | CYP3A4 (0.48) | CYP3A4MAPTMAPK1KDM4EMEN1 | |
| SCHEMBL13570262 | 0.77 | CYP3A4 (0.42) | CYP3A4MAPTMAPK1KDM4EMEN1 | |
| SCHEMBL26830176 | 0.69 | KARS1 (0.55) | CYP3A4MAPTMAPK1MEN1TP53 | |
| SCHEMBL30018920 | 0.69 | KARS1 (0.55) | CYP3A4MAPTMAPK1MEN1TP53 | |
| SCHEMBL151741 | 0.68 | KARS1 (0.56) | CYP3A4MAPTMAPK1KDM4EMEN1 | |
| SCHEMBL151742 | 0.68 | KARS1 (0.56) | CYP3A4MAPTMAPK1KDM4EMEN1 | |
| SCHEMBL151743 | 0.68 | KARS1 (0.56) | CYP3A4MAPTMAPK1KDM4EMEN1 | |
| SCHEMBL3892013 | 0.66 | PTGS1 (0.45) | CYP3A4MAPTMAPK1MEN1TP53 | |
| SCHEMBL15072076 | 0.61 | CYP3A4 (0.41) | CYP3A4MAPTMAPK1KDM4EMEN1 | |
| SCHEMBL6319704 | 0.58 | KARS1 (0.56) | CYP3A4MAPTMAPK1MEN1TP53 |
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-3127968-A1 | AQUEOUS INKJET PIGMENT DISPERSION, METHOD FOR PRODUCING SAME AND AQUEOUS INKJET INK | Fujifilm Corporation (JP) | 2017-02-08 | — | — | EP | disclosed |