Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.35 |
| ▸ | LRRK2 | Q5S007 | 6/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | PRKACA | P17612 | 2/20 | 0.31 |
| ▸ | PRKACG | P22612 | 2/20 | 0.31 |
| ▸ | PRKACB | P22694 | 2/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.30 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9556375 | 0.84 | MAPKAPK2 (0.38) | MAPKAPK2SLC6A2SLC6A4SLC6A3OPRL1 | |
| SCHEMBL28771523 | 0.77 | PRKACA (0.49) | HTR2CHTR2BPRKACAPRKACGPRKACB | |
| SCHEMBL14896356 | 0.75 | CYP11B1 (0.40) | LRRK2SLC6A2SLC6A4SLC6A3OPRL1 | |
| SCHEMBL12533540 | 0.71 | LMNA (0.38) | MAPKAPK2ALDH1A1 | |
| SCHEMBL29209742 | 0.71 | OPRL1 (0.39) | LRRK2SLC6A2SLC6A4SLC6A3OPRL1 | |
| SCHEMBL30881887 | 0.71 | OPRL1 (0.39) | LRRK2SLC6A2SLC6A4SLC6A3OPRL1 | |
| SCHEMBL1499246 | 0.70 | ADRA1A (0.43) | SLC6A2SLC6A4SLC6A3HTR2CHTR2B | |
| SCHEMBL29537759 | 0.70 | ADRA1A (0.43) | SLC6A2SLC6A4SLC6A3HTR2CHTR2B | |
| SCHEMBL14723162 | 0.69 | AR (0.41) | CYP11B1CYP11B2 | |
| SCHEMBL9691788 | 0.69 | ALDH1A1 (0.34) | MAPKAPK2ALDH1A1HPGD |
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-2013062837-A1 | PIPERIDINE DERIVATIVES USEFUL AS GPR119 AGONISTS | MERCK SHARP & DOHME CORP. (US) | 2013-05-02 | — | — | WO | disclosed |