Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | CMA1 | P23946 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | FPR1 | P21462 | 1/20 | 0.40 |
| ▸ | FPR2 | P25090 | 1/20 | 0.40 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CCR8 | P51685 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL19661753 | 0.87 | ROCK2 (0.39) | MAPTKDM4EALDH1A1TP53MEN1 | |
| SCHEMBL19661590 | 0.81 | CMA1 (0.46) | MAPTTP53CMA1FPR1FPR2 | |
| SCHEMBL17912952 | 0.79 | MAPT (0.51) | MAPTKDM4EALDH1A1TP53CMA1 | |
| SCHEMBL19661513 | 0.78 | CMA1 (0.44) | MAPTALDH1A1TP53CMA1PIK3R1 | |
| SCHEMBL17912899 | 0.76 | MAPT (0.51) | MAPTKDM4EALDH1A1CMA1MEN1 | |
| SCHEMBL17912914 | 0.72 | MAPT (0.57) | MAPTALDH1A1TP53CMA1MEN1 | |
| SCHEMBL17912978 | 0.72 | MAPT (0.57) | MAPTALDH1A1TP53CMA1MEN1 | |
| SCHEMBL17920343 | 0.70 | ROCK2 (0.49) | MAPTALDH1A1TP53CMA1LMNA | |
| SCHEMBL19759551 | 0.70 | CMA1 (0.50) | MAPTKDM4EALDH1A1TP53CMA1 | |
| SCHEMBL22241408 | 0.70 | ROCK2 (0.49) | MAPTALDH1A1TP53CMA1LMNA |
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-3464262-B1 | TRIAZOLONES AND TETRAZOLONES AS INHIBITORS OF ROCK | BRISTOL MYERS SQUIBB CO (US) | 2020-02-26 | — | — | EP | disclosed |