Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | HTR1A | P08908 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | NOS3 | P29474 | 1/20 | 0.38 |
| ▸ | NOS1 | P29475 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | USP2 | O75604 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22330440 | 0.87 | NOS3 (0.45) | ALDH1A1SLC6A2NOS3NOS1NOS2 | |
| SCHEMBL5732429 | 0.81 | ALDH1A1 (0.38) | ALDH1A1HSD17B10HPGDHTR1ASLC6A2 | |
| SCHEMBL6668714 | 0.81 | SIGMAR1 (0.41) | ALDH1A1HSD17B10HPGDHTR1ASLC6A2 | |
| SCHEMBL25268844 | 0.75 | ALDH1A1 (0.44) | ALDH1A1HSD17B10HPGDSLC6A2SLC6A4 | |
| Hydrochloric Acid SCHEMBL25224291 | 0.73 | ALDH1A1 (0.43) | ALDH1A1HSD17B10HPGDSLC6A2SLC6A4 | |
| SCHEMBL746867 | 0.73 | ALDH1A1 (0.46) | ALDH1A1HSD17B10HPGDSLC6A2SLC6A4 | |
| SCHEMBL24576052 | 0.72 | HTR2A (0.37) | ALDH1A1HSD17B10HPGDCYP1A2CYP2D6 | |
| SCHEMBL23333488 | 0.72 | OPRM1 (0.57) | SLC6A2SLC6A4OPRM1HTR2CADRB1 | |
| SCHEMBL16835918 | 0.69 | AVPR1A (0.48) | ALDH1A1HSD17B10HPGDCYP1A2OPRM1 | |
| SCHEMBL16835992 | 0.69 | AVPR1A (0.48) | ALDH1A1HSD17B10HPGDCYP1A2OPRM1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1805951-A | Substituted piperidine carbamates for use as inhibitors of hormone sensitive lipase | NOVO NORDISK AS (DK) | 2006-07-19 | — | — | CN | disclosed |