Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.56 |
| ▸ | TP53 | P04637 | 3/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | LPO | P22079 | 3/20 | 0.54 |
| ▸ | CMA1 | P23946 | 1/20 | 0.50 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL17912935 | 0.81 | POLB (0.54) | MAPTTP53LMNARXFP1 | |
| SCHEMBL17912900 | 0.80 | TP53 (0.48) | MAPTTP53LMNALPOCMA1 | |
| SCHEMBL19759685 | 0.80 | ROCK2 (0.71) | ROCK2 | |
| SCHEMBL19643602 | 0.75 | ROCK2 (0.60) | MAPTTP53LMNACMA1RXFP1 | |
| SCHEMBL17912990 | 0.74 | ROCK2 (0.68) | ROCK2 | |
| SCHEMBL19759691 | 0.74 | ROCK2 (0.73) | ROCK2 | |
| SCHEMBL17912981 | 0.74 | MEN1 (0.56) | LMNACMA1HTTTSHRALOX15 | |
| SCHEMBL19759774 | 0.74 | ROCK2 (0.73) | ROCK2 | |
| SCHEMBL17912998 | 0.73 | ROCK2 (0.46) | LMNAROCK2MAOB | |
| SCHEMBL19643781 | 0.73 | ROCK2 (0.67) | MAPTTP53ROCK2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107406426-A | Cyclic ureas as ROCK inhibitors | 百时美施贵宝公司 | 2017-11-28 | — | — | CN | disclosed |