Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.43 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.43 |
| ▸ | TAS1R2 | Q8TE23 | 2/20 | 0.43 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.41 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.41 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.41 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.41 |
| ▸ | PTPN7 | P35236 | 2/20 | 0.40 |
| ▸ | DUSP3 | P51452 | 2/20 | 0.40 |
| ▸ | VNN1 | O95497 | 8/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | KIF11 | P52732 | 1/20 | 0.37 |
| ▸ | MPL | P40238 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL4394316 | 0.98 | TAS1R3 (0.42) | TAS1R3TAS1R1TAS1R2KCNQ3KCNQ2 | |
| SCHEMBL1964418 | 0.84 | HDAC8 (0.46) | TAS1R3TAS1R1TAS1R2KCNQ3KCNQ2 | |
| SCHEMBL29788387 | 0.84 | HDAC8 (0.46) | TAS1R3TAS1R1TAS1R2KCNQ3KCNQ2 | |
| SCHEMBL4875325 | 0.80 | PRSS1 (0.42) | TAS1R3TAS1R1TAS1R2KCNQ3KCNQ2 | |
| SCHEMBL25216423 | 0.79 | TAS1R3 (0.56) | TAS1R3TAS1R1TAS1R2KCNQ3KCNQ2 | |
| SCHEMBL22561756 | 0.76 | NOTUM (0.47) | TAS1R3TAS1R1TAS1R2KCNQ3KCNQ2 | |
| SCHEMBL3971144 | 0.74 | TAS1R3 (0.51) | TAS1R3TAS1R1TAS1R2KCNQ3KCNQ2 | |
| SCHEMBL3976727 | 0.73 | TAS1R3 (0.53) | TAS1R3TAS1R1TAS1R2KCNQ3KCNQ2 | |
| Hydrochloric Acid SCHEMBL8506547 | 0.73 | TAS1R3 (0.50) | TAS1R3TAS1R1TAS1R2KCNQ3KCNQ2 | |
| SCHEMBL16527165 | 0.73 | PTPN7 (0.47) | TAS1R3TAS1R1TAS1R2KCNQ3KCNQ2 |
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 |