Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPRS1 | P07814 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | F10 | P00742 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1539828 | 0.90 | CYP3A4 (0.41) | ALDH1A1MAPTPTGDR2KMT2AMEN1 | |
| SCHEMBL4246291 | 0.90 | KMT2A (0.40) | ALDH1A1MAPTPTGDR2KMT2AMEN1 | |
| SCHEMBL27913794 | 0.88 | KMT2A (0.41) | ALDH1A1MAPK1MAPTPTGDR2KMT2A | |
| SCHEMBL986595 | 0.81 | ALDH1A1 (0.42) | HDAC2GRM2CYP1B1ALDH1A1MAPK1 | |
| SCHEMBL6013880 | 0.80 | NPC1 (0.37) | ALDH1A1MAPTKMT2AMEN1ACHE | |
| SCHEMBL27792351 | 0.79 | BCAT2 (0.39) | ALDH1A1MAPK1MAPTPTGDR2KMT2A | |
| SCHEMBL28652203 | 0.78 | MAPK1 (0.39) | HDAC2GRM2ALDH1A1MAPK1MAPT | |
| SCHEMBL19832033 | 0.76 | ALDH1A1 (0.43) | HDAC2GRM2CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL28005325 | 0.76 | ADORA2A (0.36) | ALDH1A1MAPK1MAPTPOLBPTGDR2 | |
| SCHEMBL22125988 | 0.75 | MMP9 (0.35) | ALDH1A1MAPK1MAPTPTGDR2KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-103204996-B | Organic electroluminescence device | MERCK PATENT GMBH (DE) | 2015-12-09 | — | — | CN | disclosed |