Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16884691 | 0.78 | TSHR (0.44) | TSHRALOX15TP53MEN1ALDH1A1 | |
| SCHEMBL1781860 | 0.67 | — | — | |
| SCHEMBL15450107 | 0.64 | LMNA (0.66) | TSHRALOX15MEN1ALDH1A1KMT2A | |
| SCHEMBL1783157 | 0.64 | LMNA (0.66) | TSHRALOX15MEN1ALDH1A1KMT2A | |
| SCHEMBL12909964 | 0.64 | LMNA (0.66) | TSHRALOX15MEN1ALDH1A1KMT2A | |
| SCHEMBL12836372 | 0.63 | TSHR (0.40) | TSHRALOX15TP53MEN1ALDH1A1 | |
| SCHEMBL20969496 | 0.63 | ALDH1A1 (0.70) | TSHRALOX15TP53MEN1ALDH1A1 | |
| SCHEMBL20969065 | 0.63 | ALDH1A1 (0.70) | TSHRALOX15TP53MEN1ALDH1A1 | |
| SCHEMBL14865585 | 0.63 | MEN1 (0.38) | TSHRALOX15TP53MEN1ALDH1A1 | |
| SCHEMBL9538590 | 0.63 | ALDH1A1 (0.70) | TSHRALOX15TP53MEN1ALDH1A1 |
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-2014134388-A1 | PHENYLPYRAZOLE DERIVATIVES AS POTENT ROCK1 AND ROCK2 INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2014-09-04 | — | — | WO | disclosed |