Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.62 |
| ▸ | HTT | P42858 | 2/20 | 0.62 |
| ▸ | MAPT | P10636 | 1/20 | 0.62 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.62 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.56 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13185587 | 0.87 | ALDH1A1 (0.51) | ALDH1A1KDM4ETDP1HTTMAPT | |
| SCHEMBL24732893 | 0.87 | ALDH1A1 (0.51) | ALDH1A1KDM4ETDP1HTTMAPT | |
| SCHEMBL11481170 | 0.87 | ADRA1D (0.52) | ALDH1A1KDM4ETDP1HTTMAPT | |
| SCHEMBL24732865 | 0.87 | ALDH1A1 (0.51) | ALDH1A1KDM4ETDP1HTTMAPT | |
| SCHEMBL26667595 | 0.86 | KDM4E (0.54) | ALDH1A1KDM4ETDP1HTTMAPT | |
| SCHEMBL1474097 | 0.86 | KDM4E (0.69) | ALDH1A1KDM4ETDP1HTTMAPT | |
| SCHEMBL621117 | 0.86 | KDM4E (0.69) | ALDH1A1KDM4ETDP1HTTMAPT | |
| SCHEMBL14049765 | 0.86 | KDM4E (0.54) | ALDH1A1KDM4ETDP1HTTMAPT | |
| SCHEMBL31010155 | 0.86 | ALDH1A1 (0.54) | ALDH1A1KDM4ETDP1HTTMAPT | |
| SCHEMBL619338 | 0.83 | KDM4E (0.71) | ALDH1A1KDM4ETDP1HTTMAPT |
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-0010896-B1 | ORGANIC DIAMINE COMPOUNDS FOR USE AS ORAL HYPOGLYCEMIC AGENTS AND PHARMACEUTICAL COMPOSITIONS THEREOF | PFIZER INC. (US) | 1981-12-30 | — | — | EP | disclosed |