Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 13/20 | 0.44 |
| ▸ | PDE3A | Q14432 | 13/20 | 0.44 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 4/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA3 | P07451 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA6 | P23280 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4146416 | 0.78 | PDE3B (0.44) | PDE3BPDE3ACRBNPARP1TP53 | |
| SCHEMBL981139 | 0.77 | PARP1 (0.48) | PARP1KDM4EALDH1A1LMNACYP1A2 | |
| SCHEMBL4714559 | 0.75 | CRBN (0.48) | PDE3BPDE3ACRBNPARP1TP53 | |
| SCHEMBL15451017 | 0.71 | GAA (0.48) | PARP1TP53KDM4EALDH1A1LMNA | |
| SCHEMBL1438410 | 0.68 | CA12 (0.47) | PDE3BPDE3ACA12CA1CA3 | |
| SCHEMBL30946262 | 0.68 | CA12 (0.47) | PDE3BPDE3ACA12CA1CA3 | |
| SCHEMBL24189567 | 0.67 | KDM4E (0.53) | KDM4EALDH1A1LMNACYP1A2CYP2C9 | |
| SCHEMBL30528248 | 0.67 | PARP1 (0.40) | PARP1CA12CA9KDM4EALDH1A1 | |
| SCHEMBL12755333 | 0.67 | PIM1 (0.38) | PARP1KDM4EALDH1A1LMNACYP1A2 | |
| SCHEMBL16736421 | 0.67 | CA12 (0.55) | PDE3BPDE3ACRBNTP53CA12 |
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-2009146034-A2 | MAPK/ERK KINASE INHIBITORS AND METHODS OF USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-12-03 | — | — | WO | claimed |