Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6902172 | 0.99 | CYP2D6 (0.32) | CYP2D6SLC6A2SLC6A4PDK2KMT2A | |
| SCHEMBL6901040 | 0.80 | GABRA1 (0.31) | — | |
| Hydrochloric Acid SCHEMBL6901092 | 0.79 | GABRA1 (0.30) | — | |
| Hydrochloric Acid SCHEMBL6902890 | 0.78 | — | — | |
| SCHEMBL6897784 | 0.77 | ITGA4 (0.31) | PDK2 | |
| Hydrochloric Acid SCHEMBL6904006 | 0.76 | ITGA4 (0.31) | PDK2 | |
| SCHEMBL6900114 | 0.74 | GRIN1 (0.31) | — | |
| Hydrochloric Acid SCHEMBL6902720 | 0.73 | ALDH1A1 (0.34) | GAASMN1; SMN2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL6895488 | 0.73 | GRIN1 (0.30) | — | |
| Hydrochloric Acid SCHEMBL6904522 | 0.71 | ABL1 (0.34) | PDK2SMN1; SMN2ALDH1A1 |
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-1033371-B1 | Transition metal compound, catalyst system, process for the preparation thereof and its use for the polymerization of olefins | BASELL POLYOLEFINE GMBH (DE) | 2004-01-28 | — | — | EP | claimed |