Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 11/20 | 0.56 |
| ▸ | ESR1 | P03372 | 6/20 | 0.47 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.40 |
| ▸ | CDK1 | P06493 | 1/20 | 0.38 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.38 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.38 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.38 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.38 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL23025212 | 0.86 | KDM4E (0.47) | HRH4MKNK2CDK1CCNB1CCNA2 | |
| SCHEMBL23025208 | 0.86 | KDM4E (0.47) | HRH4MKNK2CDK1CCNB1CCNA2 | |
| SCHEMBL23025015 | 0.80 | HRH4 (0.40) | HRH4MKNK2CDK1CCNB1CCNA2 | |
| SCHEMBL12763798 | 0.79 | HRH4 (0.54) | HRH4ESR1ESR2HCAR3HCAR2 | |
| SCHEMBL22433534 | 0.79 | HRH4 (0.50) | HRH4ESR1ESR2HCAR3HCAR2 | |
| SCHEMBL10188164 | 0.79 | EGFR (0.49) | HRH4MKNK2CDK1CCNB1CCNA2 | |
| SCHEMBL31696274 | 0.78 | HRH4 (0.49) | HRH4ESR1ESR2HCAR3HCAR2 | |
| SCHEMBL20929745 | 0.76 | HRH4 (0.45) | HRH4MKNK2CDK1CCNB1CCNA2 | |
| SCHEMBL30138279 | 0.76 | HRH4 (0.45) | HRH4MKNK2CDK1CCNB1CCNA2 | |
| SCHEMBL10187338 | 0.76 | DNM2 (0.45) | HRH4ESR1CDK1CCNB1CCNA2 |
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-2012001107-A1 | PIPERIDINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF METABOLIC DISORDERS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2012-01-05 | — | — | WO | disclosed |