Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.43 |
| ▸ | PRKX | P51817 | 1/20 | 0.43 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.43 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 3/20 | 0.41 |
| ▸ | MAOB | P27338 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | LTA4H | P09960 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14968335 | 0.86 | NPC1 (0.46) | S1PR1S1PR5HRH3MAOAMAOB | |
| SCHEMBL14968227 | 0.84 | HRH3 (0.44) | HRH3MAOAMAOBMEN1NPC1 | |
| SCHEMBL190184 | 0.70 | HPGD (0.58) | S1PR1PRKXACVR1S1PR5HPGD | |
| SCHEMBL7146821 | 0.70 | ALOX5 (0.47) | S1PR1PRKXACVR1S1PR5MAOA | |
| SCHEMBL14970460 | 0.68 | S1PR1 (0.57) | S1PR1PRKXACVR1S1PR5HRH3 | |
| SCHEMBL15876111 | 0.68 | S1PR1 (0.54) | S1PR1PRKXACVR1S1PR5HPGD | |
| SCHEMBL12180347 | 0.68 | DRD2 (0.56) | HRH3MAOAMAOBMEN1NPC1 | |
| SCHEMBL30402795 | 0.67 | MAOA (0.56) | HPGDMAOAMAOBMEN1NPC1 | |
| SCHEMBL4079311 | 0.67 | MAOA (0.56) | HPGDMAOAMAOBMEN1NPC1 | |
| SCHEMBL210293 | 0.67 | MAOA (0.55) | HPGDMAOAMAOBMEN1NPC1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2780337-A1 | SUBSTITUTED CYCLOPROPYL COMPOUNDS USEFUL AS GPR119 AGONISTS | Merck Sharp & Dohme Corp. (US) | 2014-09-24 | — | — | EP | disclosed |
| WO-2013074388-A1 | SUBSTITUTED CYCLOPROPYL COMPOUNDS USEFUL AS GPR119 AGONISTS | MERCK SHARP & DOHME CORP. (US) | 2013-05-23 | — | — | WO | disclosed |