Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.43 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.43 |
| ▸ | MC4R | P32245 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.40 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.40 |
| ▸ | SLC6A1 | P30531 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL23120768 | 0.85 | TSHR (0.44) | KDM4EMAPTHIF1AMC4RSSTR4 | |
| SCHEMBL9510110 | 0.84 | GBA1 (0.46) | MC4RL3MBTL1SLC6A1 | |
| SCHEMBL15684283 | 0.84 | S1PR1 (0.50) | KDM4EMAPTHIF1AS1PR1S1PR5 | |
| SCHEMBL11243295 | 0.77 | ARG1 (0.54) | KDM4EMAPTHIF1A | |
| SCHEMBL31536414 | 0.77 | ALDH1A1 (0.46) | S1PR1S1PR5POLB | |
| SCHEMBL11243299 | 0.77 | ARG1 (0.54) | KDM4EMAPTHIF1A | |
| SCHEMBL27873233 | 0.76 | GLA (0.47) | L3MBTL1 | |
| SCHEMBL7814243 | 0.76 | POLB (0.54) | KDM4EMAPTHIF1AS1PR1S1PR5 | |
| SCHEMBL16995701 | 0.74 | GRIN2B (0.45) | — | |
| SCHEMBL16601277 | 0.74 | GRIN2B (0.45) | — |
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-2613782-A2 | INDAZOLE DERIVATIVES USEFUL AS ERK INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2013-07-17 | — | — | EP | disclosed |
| WO-2012030685-A2 | INDAZOLE DERIVATIVES USEFUL AS ERK INHIBITORS | SCHERING CORPORATION (US) | 2012-03-08 | — | — | WO | disclosed |