Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.62 |
| ▸ | POLB | P06746 | 2/20 | 0.59 |
| ▸ | HRH3 | Q9Y5N1 | 11/20 | 0.57 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
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 SCHEMBL2528505 | 0.99 | KDM4E (0.61) | KDM4EALDH1A1SMN1; SMN2POLBHRH3 | |
| SCHEMBL7564110 | 0.86 | KDM4E (0.82) | KDM4EALDH1A1SMN1; SMN2POLBHRH3 | |
| SCHEMBL14970474 | 0.84 | KDM4E (0.75) | KDM4EALDH1A1SMN1; SMN2POLBHRH3 | |
| SCHEMBL9527128 | 0.84 | MEN1 (0.77) | ALDH1A1HRH3MEN1KMT2A | |
| SCHEMBL9532038 | 0.83 | HRH3 (0.48) | KDM4EALDH1A1HRH3MEN1KMT2A | |
| SCHEMBL7398924 | 0.83 | KDM4E (0.73) | KDM4EALDH1A1SMN1; SMN2POLBHRH3 | |
| SCHEMBL7399802 | 0.83 | KDM4E (0.73) | KDM4EALDH1A1SMN1; SMN2POLBHRH3 | |
| SCHEMBL7396432 | 0.83 | KDM4E (0.73) | KDM4EALDH1A1SMN1; SMN2POLBHRH3 | |
| Hydrochloric Acid SCHEMBL9528262 | 0.82 | KMT2A (0.75) | ALDH1A1HRH3MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL7395361 | 0.82 | KDM4E (0.71) | KDM4EALDH1A1SMN1; SMN2POLBHRH3 |
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-0542846-A1 | N-HYDROCARBYL-4-SUBSTITUTED PIPERIDINES, THEIR PREPARATION AND USE AS CALCIUM BLOCKING AGENTS | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1993-05-26 | — | — | EP | claimed |