Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PORCN | Q9H237 | 2/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.36 |
| ▸ | KHK | P50053 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | NAMPT | P43490 | 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 | |
|---|---|---|---|---|
| SCHEMBL15021783 | 0.78 | MAPK1 (0.46) | — | |
| SCHEMBL18197030 | 0.76 | SSTR4 (0.37) | SLC6A3 | |
| SCHEMBL18197001 | 0.76 | MAP2K1 (0.33) | NAMPT | |
| SCHEMBL18197025 | 0.75 | NAMPT (0.39) | KHKALDH1A1NAMPT | |
| SCHEMBL27672018 | 0.69 | SLC6A2 (0.48) | SLC6A2SLC6A4SLC6A3ADRB1 | |
| SCHEMBL38661140 | 0.66 | ADRB2 (0.41) | MAPTNPSR1ALDH1A1 | |
| SCHEMBL27529782 | 0.66 | SLC6A4 (0.53) | SLC6A2SLC6A4SLC6A3ADRB1ALDH1A1 | |
| SCHEMBL9396845 | 0.66 | SLC6A2 (0.53) | SLC6A2SLC6A4SLC6A3ADRB1ALDH1A1 | |
| SCHEMBL20140971 | 0.66 | SLC6A2 (0.53) | SLC6A2SLC6A4SLC6A3ADRB1ALDH1A1 | |
| SCHEMBL16731889 | 0.66 | SLC6A4 (0.47) | SLC6A2SLC6A4SLC6A3ADRB1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2613782-B1 | INDAZOLE DERIVATIVES USEFUL AS ERK INHIBITORS | MERCK SHARP & DOHME (US) | 2016-11-02 | — | — | EP | disclosed |