Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK5 | Q00535 | 4/20 | 0.50 |
| ▸ | CDK5R1 | Q15078 | 4/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.50 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.50 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | TTR | P02766 | 2/20 | 0.35 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 2/20 | 0.35 |
| ▸ | CDC25A | P30304 | 2/20 | 0.35 |
| ▸ | CDC25B | P30305 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30661163 | 0.78 | BACE1 (0.52) | MAPTMEN1KMT2APTPN1IDO1 | |
| SCHEMBL8162066 | 0.78 | BACE1 (0.52) | MAPTMEN1KMT2APTPN1IDO1 | |
| SCHEMBL11563253 | 0.67 | MAPT (1.00) | CDK5CDK5R1MAPTHSP90AA1NCOA1 | |
| SCHEMBL11563250 | 0.67 | MAPT (1.00) | CDK5CDK5R1MAPTHSP90AA1NCOA1 | |
| SCHEMBL3401938 | 0.66 | KMT2A (0.94) | CDK5CDK5R1MAPTHSP90AA1NCOA1 | |
| SCHEMBL29493736 | 0.66 | KMT2A (0.94) | CDK5CDK5R1MAPTHSP90AA1NCOA1 | |
| SCHEMBL17988338 | 0.65 | MEN1 (0.71) | CDK5CDK5R1MAPTHSP90AA1NCOA1 | |
| SCHEMBL11802296 | 0.64 | LMNA (0.33) | MAPTPTPN1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL31286023 | 0.64 | KMT2A (0.88) | CDK5CDK5R1MAPTHSP90AA1NCOA1 | |
| SCHEMBL17546590 | 0.64 | KMT2A (0.88) | CDK5CDK5R1MAPTHSP90AA1NCOA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-3931255-A | REDUCING OXIME, IRON(2) IONS AND HYDROGEN HALIDE, OXIDIZING THE NAPHTHOL | BAYER AKTIENGESELLSCHAFT (DT) | 1976-01-06 | — | — | US | disclosed |