Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.36 |
| ▸ | GFER | P55789 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL352276 | 0.77 | GAA (0.53) | ALDH1A1L3MBTL1LMNAGAAMEN1 | |
| SCHEMBL4399169 | 0.74 | ALDH1A1 (0.37) | ALDH1A1L3MBTL1LMNAGAAMEN1 | |
| Hydrochloric Acid SCHEMBL27082561 | 0.74 | NPSR1 (0.43) | ALDH1A1LMNANPSR1TSHR | |
| SCHEMBL21184566 | 0.71 | ALDH1A1 (0.35) | ALDH1A1L3MBTL1LMNAGAAMEN1 | |
| SCHEMBL358889 | 0.70 | ALDH1A1 (0.47) | ALDH1A1L3MBTL1LMNAGAAMEN1 | |
| SCHEMBL12807883 | 0.70 | ALDH1A1 (0.40) | ALDH1A1L3MBTL1LMNAGAAMEN1 | |
| SCHEMBL223413 | 0.70 | GAA (0.49) | ALDH1A1L3MBTL1LMNAGAAMEN1 | |
| SCHEMBL21617368 | 0.68 | GAA (0.55) | ALDH1A1L3MBTL1GAAMEN1KMT2A | |
| SCHEMBL193631 | 0.68 | LMNA (0.50) | ALDH1A1L3MBTL1LMNAGAAMEN1 | |
| SCHEMBL2928119 | 0.67 | GRIA1 (0.32) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101321525-B | Heteroaryl substituted piperidine derivatives as L-CPT1 inhibitors | HOFFMANN LA ROCHE | 2013-01-30 | — | — | CN | disclosed |
| EP-1959951-B1 | HETEROARYL SUBSTITUTED PIPERIDINE DERIVATIVES AS L-CPT1 INHIBITORS | HOFFMANN LA ROCHE (CH) | 2009-12-23 | — | — | EP | disclosed |
| CN-101321525-A | Heteroaryl substituted piperidine derivatives as L-CPT1 inhibitors | HOFFMANN LA ROCHE (CH) | 2008-12-10 | — | — | CN | disclosed |