Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | MTOR | P42345 | 1/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 10/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 10/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16803390 | 0.86 | CYP11B1 (0.37) | CYP11B1CYP11B2ADORA2AADORA2BADORA1 | |
| SCHEMBL1785054 | 0.85 | KCNH2 (0.40) | CYP2C9TSHRCYP2C19MTORHRH4 | |
| SCHEMBL12064369 | 0.83 | CYP11B1 (0.41) | CYP2C9CYP2C19HRH3CYP11B1CYP11B2 | |
| SCHEMBL15996487 | 0.80 | ADORA2A (0.33) | CYP2C9CYP2C19CYP11B1CYP11B2ADORA2A | |
| SCHEMBL12056295 | 0.79 | IDO1 (0.39) | CYP11B1CYP11B2 | |
| SCHEMBL8830161 | 0.79 | CYP11B1 (0.39) | CYP11B1CYP11B2 | |
| SCHEMBL21558721 | 0.77 | KCNH2 (0.34) | CYP11B1CYP11B2ADORA2AADORA2BADORA1 | |
| SCHEMBL5391398 | 0.77 | CYP11B1 (0.45) | CYP11B1CYP11B2ADORA2AADORA2BADORA1 | |
| SCHEMBL20439593 | 0.77 | KCNH2 (0.34) | ADORA2B | |
| SCHEMBL14415973 | 0.76 | CYP11B1 (0.33) | CYP2C9TSHRCYP2C19MTORHRH4 |
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-2007084498-A1 | PIPERAZINE DERIVATIVES AS FARNESYL PROTEIN TRANSFERASE INHIBITORS | SCHERING CORPORATION (US) | 2007-07-26 | — | — | WO | disclosed |