Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 2/20 | 0.39 |
| ▸ | CCR8 | P51685 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TYMP | P19971 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | FTO | Q9C0B1 | 2/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.32 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.32 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4240700 | 0.74 | CCR8 (0.46) | ADORA1CCR8KMT2AALDH1A1FTO | |
| SCHEMBL12410495 | 0.67 | CCR8 (0.56) | ADORA1CCR8KMT2ATYMPGSK3B | |
| SCHEMBL26064174 | 0.64 | CA12 (0.40) | ALDH1A1MAOAMAOBCRBNPDE3B | |
| SCHEMBL5925814 | 0.62 | CRBN (0.46) | ADORA1TYMPGSK3BBACE1ALDH1A1 | |
| SCHEMBL19318056 | 0.58 | CCR8 (1.00) | ADORA1CCR8KMT2ATYMPGSK3B | |
| SCHEMBL30774416 | 0.58 | CCR8 (1.00) | ADORA1CCR8KMT2ATYMPGSK3B | |
| SCHEMBL2114197 | 0.58 | CCR8 (0.45) | CCR8KMT2AALDH1A1FTOMAOA | |
| SCHEMBL4146416 | 0.55 | PDE3B (0.44) | KMT2AALDH1A1CRBNPDE3BPDE3A | |
| SCHEMBL4474044 | 0.55 | PDE3B (0.44) | ALDH1A1CRBNPDE3BPDE3ATP53 | |
| SCHEMBL26540138 | 0.54 | AR (0.50) | — |
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-2150544-A2 | MAPK/ERK KINASE INHIBITORS | Takeda Pharmaceutical Company Limited (JP) | 2010-02-10 | — | — | EP | disclosed |
| WO-2008115890-A2 | MAPK/ERK KINASE INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2008-09-25 | — | — | WO | disclosed |