Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.31 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | NAAA | Q02083 | 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 | |
|---|---|---|---|---|
| SCHEMBL6582737 | 0.80 | ALDH1A1 (0.36) | ALDH1A1CYP4F2CYP4A11MEN1KMT2A | |
| SCHEMBL6583645 | 0.79 | ALDH1A1 (0.35) | ALDH1A1CYP4F2CYP4A11MEN1KMT2A | |
| SCHEMBL6582646 | 0.77 | KMT2A (0.45) | NPC1ALDH1A1CYP4F2CYP4A11MEN1 | |
| SCHEMBL6580482 | 0.76 | KMT2A (0.44) | NPC1ALDH1A1CYP4F2CYP4A11MEN1 | |
| SCHEMBL6580481 | 0.76 | POLB (0.33) | ALDH1A1CYP4F2CYP4A11KMT2ALMNA | |
| SCHEMBL17860704 | 0.75 | ALDH1A1 (0.48) | ALDH1A1LMNAPOLBSMN1; SMN2NAAA | |
| SCHEMBL2289682 | 0.75 | SMN1; SMN2 (0.44) | NPC1ALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL31050190 | 0.74 | CYP3A4 (0.39) | ALDH1A1CYP4F2CYP4A11MEN1KMT2A | |
| SCHEMBL16701074 | 0.73 | CYP4F2 (0.37) | CYP4F2CYP4A11MEN1KMT2APOLB | |
| SCHEMBL7548982 | 0.73 | CHRM2 (0.38) | ALDH1A1CYP4F2CYP4A11MEN1KMT2A |
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-1154993-B1 | THIOAMIDE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2004-10-06 | — | — | EP | disclosed |