Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.53 |
| ▸ | BACE1 | P56817 | 1/20 | 0.53 |
| ▸ | MAOA | P21397 | 4/20 | 0.45 |
| ▸ | MAOB | P27338 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | RECQL | P46063 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | APEX1 | P27695 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | MDM2 | Q00987 | 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 | |
|---|---|---|---|---|
| SCHEMBL7915011 | 0.85 | ACHE (0.61) | ACHEBACE1MAOAMAOBALDH1A1 | |
| SCHEMBL2027891 | 0.80 | MAOA (0.48) | ACHEBACE1MAOAMAOBALDH1A1 | |
| SCHEMBL20087552 | 0.80 | ACHE (0.69) | ACHEBACE1MAOAMAOBALDH1A1 | |
| SCHEMBL14680383 | 0.78 | ACHE (0.80) | ACHEBACE1MAOAMAOBALDH1A1 | |
| SCHEMBL5051489 | 0.76 | ACHE (0.70) | ACHEBACE1MAOAMAOBALDH1A1 | |
| SCHEMBL1533949 | 0.76 | ACHE (0.53) | ACHEBACE1MAOAMAOBALDH1A1 | |
| SCHEMBL5712758 | 0.76 | ACHE (0.53) | ACHEBACE1MAOAMAOBALDH1A1 | |
| SCHEMBL8116313 | 0.76 | ACHE (0.53) | ACHEBACE1MAOAMAOBALDH1A1 | |
| Water SCHEMBL10597680 | 0.74 | ACHE (0.52) | ACHEBACE1MAOAMAOBALDH1A1 | |
| SCHEMBL28229943 | 0.74 | ACHE (0.68) | ACHEBACE1MAOAMAOBALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1057552-C | Triphenodioxazine dyes and preparation and application of same | ZENECA LTD (GB) | 2000-10-18 | — | — | CN | disclosed |
| CN-1088234-A | Three its preparation of benzo dioxazine dyestuff and purposes | ZENECA LTD (GB) | 1994-06-22 | — | — | CN | disclosed |