Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTNNB1 | P35222 | 5/20 | 0.41 |
| ▸ | TCF7L2 | Q9NQB0 | 5/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | PDE5A | O76074 | 2/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | AURKA | O14965 | 4/20 | 0.38 |
| ▸ | CDK2 | P24941 | 3/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5398656 | 0.88 | AURKA (0.47) | CTNNB1TCF7L2AURKACDK2MAPK1 | |
| SCHEMBL16893059 | 0.75 | AURKA (0.38) | KMT2AAURKACDK2MAPK1 | |
| SCHEMBL16893145 | 0.72 | AURKA (0.51) | AURKACDK2MAPK1 | |
| SCHEMBL16893001 | 0.71 | AURKA (0.54) | AURKACDK2MAPK1 | |
| SCHEMBL16893094 | 0.70 | AURKA (0.54) | AURKACDK2MAPK1 | |
| SCHEMBL16893152 | 0.70 | AURKA (0.42) | AURKACDK2MAPK1 | |
| SCHEMBL16893075 | 0.70 | MELK (0.45) | LMNAPOLBMAPTKDM4ETSHR | |
| SCHEMBL16893088 | 0.69 | AURKA (0.52) | AURKACDK2MAPK1 | |
| SCHEMBL16893129 | 0.69 | CNR1 (0.41) | POLBKDM4EAURKACDK2MAPK1 | |
| SCHEMBL16892986 | 0.68 | FAAH (0.41) | POLBMAPTHTTKMT2ASMN1; SMN2 |
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-1363906-B1 | HETEROCYCLIC INHIBITORS OF ERK2 AND USES THEREOF | VERTEX PHARMA (US) | 2015-07-15 | — | — | EP | claimed |