Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 5/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL21768494 | 0.87 | MAPT (0.48) | LMNAMEN1KMT2AMAPTTP53 | |
| SCHEMBL19643774 | 0.70 | ROCK2 (0.49) | ROCK2 | |
| SCHEMBL19661590 | 0.68 | CMA1 (0.46) | ROCK2LMNAMAPTTP53TSHR | |
| SCHEMBL17912952 | 0.67 | MAPT (0.51) | ROCK2LMNAMEN1KMT2AMAPT | |
| SCHEMBL21768536 | 0.67 | TDP2 (0.41) | LMNAMAPK1MEN1KMT2AMAPT | |
| SCHEMBL17920297 | 0.65 | USP2 (0.43) | LMNAMAPK1MEN1KMT2AMAPT | |
| SCHEMBL19661513 | 0.65 | CMA1 (0.44) | ROCK2LMNAMAPTTP53ALDH1A1 | |
| SCHEMBL17912899 | 0.63 | MAPT (0.51) | ROCK2LMNAMEN1KMT2AMAPT | |
| SCHEMBL17391139 | 0.62 | CYP4F2 (0.49) | LMNAKMT2AMAPTALDH1A1TSHR | |
| SCHEMBL19643508 | 0.62 | ROCK2 (0.73) | ROCK2 |
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-2017205709-A1 | TRIAZOLONES AND TETRAZOLONES AS INHIBITORS OF ROCK | BRISTOL-MYERS SQUIBB COMPANY (US) | 2017-11-30 | — | — | WO | disclosed |