Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.33 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | MMP14 | P50281 | 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 | |
|---|---|---|---|---|
| SCHEMBL8171344 | 0.82 | ALDH1A1 (0.41) | ALDH1A1TSHRTHRBCYP4F2CYP4A11 | |
| SCHEMBL23501501 | 0.81 | ALOX15 (0.40) | ALDH1A1TSHRALOX15THRBLMNA | |
| SCHEMBL29105122 | 0.79 | ALOX15 (0.39) | ALDH1A1TSHRALOX15LMNAHSD17B10 | |
| SCHEMBL11438402 | 0.78 | CYP4F2 (0.39) | ALDH1A1TSHRTHRBCYP4F2CYP4A11 | |
| SCHEMBL22643596 | 0.77 | ALDH1A1 (0.38) | ALDH1A1TSHRTHRBCYP4F2CYP4A11 | |
| SCHEMBL4957158 | 0.76 | LMNA (0.34) | ALDH1A1TSHRLMNAHSD17B10 | |
| SCHEMBL23868445 | 0.74 | LMNA (0.33) | LMNAHSD17B10 | |
| SCHEMBL17381349 | 0.72 | LMNA (0.41) | TSHRLMNAHSD17B10RAB9A | |
| SCHEMBL277242 | 0.72 | — | — | |
| SCHEMBL1927203 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010100070-A1 | INHIBITORS OF BRUTON'S TYROSINE KINASE | F. HOFFMANN-LA ROCHE AG (CH) | 2010-09-10 | — | — | WO | disclosed |