Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | PKM | P14618 | 2/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | F13A1 | P00488 | 1/20 | 0.49 |
| ▸ | TGM2 | P21980 | 1/20 | 0.49 |
| ▸ | TGM1 | P22735 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | HTR6 | P50406 | 2/20 | 0.48 |
| ▸ | GCK | P35557 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL893688 | 0.87 | MAPT (0.68) | ALDH1A1MAPTPKMCYP2D6POLB | |
| SCHEMBL17246 | 0.87 | MAPT (0.68) | ALDH1A1MAPTPKMCYP2D6POLB | |
| SCHEMBL15284182 | 0.85 | MAPT (0.66) | ALDH1A1MAPTPKMPOLBHTR6 | |
| Piperazine SCHEMBL28102264 | 0.85 | MAPT (0.66) | ALDH1A1MAPTPKMCYP2D6POLB | |
| Hydrochloric Acid SCHEMBL16186 | 0.85 | MAPT (0.66) | ALDH1A1MAPTPKMCYP2D6POLB | |
| Hydrochloric Acid SCHEMBL8130433 | 0.84 | MAPT (0.64) | ALDH1A1MAPTPKMCYP2D6POLB | |
| Trifluoroacetic Acid SCHEMBL25303672 | 0.84 | ALDH1A1 (0.54) | ALDH1A1MAPTKMT2AMEN1 | |
| SCHEMBL6973412 | 0.81 | ALDH1A1 (0.60) | ALDH1A1MAPTPKMCYP2D6POLB | |
| Trifluoroacetic Acid SCHEMBL6199635 | 0.78 | PKM (0.59) | ALDH1A1MAPTPKM | |
| SCHEMBL4225535 | 0.78 | ALDH1A1 (0.72) | ALDH1A1MAPTPKMPOLBKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1117651-A1 | NEW BIS-BENZIMIDAZOLES | Bayer Aktiengesellschaft (DE) | 2001-07-25 | — | — | EP | disclosed |
| WO-2000020401-A1 | NEW BIS-BENZIMIDAZOLES | BAYER AKTIENGESELLSCHAFT (DE) | 2000-04-13 | — | — | WO | disclosed |