Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 1/20 | 0.39 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.39 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.39 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.39 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.39 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.38 |
| ▸ | PIK3R1 | P27986 | 2/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.37 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.35 |
| ▸ | IDH1 | O75874 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 6/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CHKA | P35790 | 1/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | JAK3 | P52333 | 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 | |
|---|---|---|---|---|
| SCHEMBL17591565 | 0.84 | JAK2 (0.43) | CDK1CCNB1CCNA2CCNE1CDK2 | |
| SCHEMBL30579411 | 0.84 | JAK2 (0.43) | CDK1CCNB1CCNA2CCNE1CDK2 | |
| SCHEMBL18815015 | 0.77 | NPC1 (0.42) | HCAR3MAPK14MEN1KMT2A | |
| SCHEMBL23024945 | 0.77 | LRRK2 (0.39) | CDK1CCNB1CCNA2CCNE1CDK2 | |
| SCHEMBL23024921 | 0.77 | LRRK2 (0.39) | CDK1CCNB1CCNA2CCNE1CDK2 | |
| SCHEMBL30047569 | 0.74 | HTR7 (0.58) | PIK3CDPIK3R1MAPK14JAK2JAK3 | |
| SCHEMBL23059301 | 0.73 | MEN1 (0.42) | PIK3CDPIK3R1HCAR3IDH1CA2 | |
| SCHEMBL23059377 | 0.73 | MEN1 (0.42) | PIK3CDPIK3R1HCAR3IDH1CA2 | |
| SCHEMBL1911881 | 0.73 | — | — | |
| SCHEMBL29741837 | 0.73 | — | — |
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 |