Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | MLNR | O43193 | 6/20 | 0.44 |
| ▸ | ITK | Q08881 | 11/20 | 0.42 |
| ▸ | INSR | P06213 | 4/20 | 0.40 |
| ▸ | TEC | P42680 | 1/20 | 0.40 |
| ▸ | TXK | P42681 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL905171 | 0.85 | CNR2 (0.48) | TP53ITKCNR1CNR2 | |
| SCHEMBL905131 | 0.84 | TP53 (0.41) | TP53ITKCNR1CNR2 | |
| SCHEMBL10047068 | 0.83 | CNR2 (0.44) | TP53CNR1CNR2 | |
| SCHEMBL905141 | 0.81 | MLNR (0.41) | TP53MLNRITKINSR | |
| SCHEMBL905174 | 0.80 | ALDH1A1 (0.41) | TP53CNR1CNR2 | |
| SCHEMBL7051990 | 0.79 | CNR2 (0.46) | MLNRITKINSRCNR1CNR2 | |
| SCHEMBL11938472 | 0.78 | PKM (0.47) | TP53ITKCNR1CNR2 | |
| SCHEMBL905136 | 0.76 | MLNR (0.71) | MLNR | |
| SCHEMBL9001804 | 0.75 | HSD17B1 (0.49) | ITKINSR | |
| SCHEMBL9001802 | 0.72 | NR1H4 (0.53) | ITKINSR |
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-2012043445-A1 | CYCLOHEXANE DERIVATIVE COMPOUND | 第一三共株式会社 (JP) | 2012-04-05 | — | — | WO | disclosed |