Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK5 | Q00535 | 3/20 | 0.40 |
| ▸ | CDK5R1 | Q15078 | 3/20 | 0.40 |
| ▸ | TTK | P33981 | 1/20 | 0.38 |
| ▸ | BCL6 | P41182 | 1/20 | 0.38 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.35 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.35 |
| ▸ | RPS6KA5 | O75582 | 3/20 | 0.34 |
| ▸ | RPS6KA4 | O75676 | 1/20 | 0.34 |
| ▸ | CLK1 | P49759 | 1/20 | 0.33 |
| ▸ | MKNK1 | Q9BUB5 | 6/20 | 0.33 |
| ▸ | MKNK2 | Q9HBH9 | 6/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19100347 | 0.75 | TTK (0.46) | TTKRPS6KA5RPS6KA4MKNK1MKNK2 | |
| SCHEMBL28808920 | 0.73 | ROCK1 (0.51) | — | |
| SCHEMBL27947242 | 0.71 | KMT2A (0.39) | CDK5 | |
| SCHEMBL19100496 | 0.69 | RPS6KA5 (0.44) | TTKRPS6KA5RPS6KA4MKNK1MKNK2 | |
| SCHEMBL11970996 | 0.68 | MAP3K14 (0.33) | — | |
| SCHEMBL19100773 | 0.68 | RPS6KA5 (0.47) | RPS6KA5RPS6KA4 | |
| SCHEMBL30163088 | 0.68 | RPS6KA5 (0.47) | RPS6KA5RPS6KA4 | |
| SCHEMBL11970798 | 0.68 | IRAK4 (0.42) | BCL6GRM4 | |
| SCHEMBL14333535 | 0.67 | ADORA3 (0.43) | — | |
| SCHEMBL29218254 | 0.67 | HTR3E (0.37) | — |
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-103476768-A | 6, 5-heterocyclic propargyl alcohol compounds and uses thereof | HOFFMANN LA ROCHE | 2013-12-25 | — | — | CN | disclosed |