Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 17/20 | 0.40 |
| ▸ | PDE2A | O00408 | 1/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.34 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14906387 | 0.91 | GPBAR1 (0.40) | GPBAR1PDE2APDE10A | |
| SCHEMBL14906413 | 0.91 | GPBAR1 (0.39) | GPBAR1PDE2APDE10A | |
| SCHEMBL14906396 | 0.89 | GPBAR1 (0.47) | GPBAR1 | |
| SCHEMBL14906370 | 0.89 | GPBAR1 (0.40) | GPBAR1RAB9A | |
| SCHEMBL14906367 | 0.87 | KLRK1 (0.39) | GPBAR1PDE2APDE10A | |
| SCHEMBL14906417 | 0.86 | GPBAR1 (0.36) | GPBAR1PDE2APDE10AIDO1 | |
| SCHEMBL14906397 | 0.85 | GPBAR1 (0.39) | GPBAR1 | |
| SCHEMBL14895848 | 0.85 | S1PR1 (0.37) | GPBAR1PDE2APDE10ARAB9AIDO1 | |
| SCHEMBL14906369 | 0.84 | IDO1 (0.42) | GPBAR1IDO1 | |
| SCHEMBL14906516 | 0.81 | GPBAR1 (0.47) | GPBAR1 |
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-2013062887-A1 | SUBSTITUTED PYRIDINE DERIVATIVES USEFUL AS GPR131 AGONISTS | MERCK SHARP & DOHME CORP. (US) | 2013-05-02 | — | — | WO | disclosed |