Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PFKFB3 | Q16875 | 8/20 | 0.39 |
| ▸ | PFKFB1 | P16118 | 7/20 | 0.39 |
| ▸ | PFKFB2 | O60825 | 6/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.34 |
| ▸ | TYK2 | P29597 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL21653293 | 0.85 | PFKFB3 (0.41) | PFKFB3PFKFB1PFKFB2KDM4EALDH1A1 | |
| SCHEMBL21653001 | 0.84 | PFKFB3 (0.40) | PFKFB3PFKFB1PFKFB2KDM4EALDH1A1 | |
| SCHEMBL21653295 | 0.80 | PFKFB3 (0.55) | PFKFB3PFKFB1PFKFB2PSMB8 | |
| SCHEMBL21652996 | 0.78 | PFKFB3 (0.40) | PFKFB3PFKFB1PFKFB2KDM4EALDH1A1 | |
| SCHEMBL21652994 | 0.77 | PFKFB3 (0.44) | PFKFB3PFKFB1PFKFB2KDM4EALDH1A1 | |
| SCHEMBL21653296 | 0.77 | ALDH1A1 (0.38) | PFKFB3PFKFB1PFKFB2KDM4EALDH1A1 | |
| SCHEMBL21653197 | 0.76 | RAB9A (0.55) | KDM4EALDH1A1LMNANPC1HPGD | |
| SCHEMBL21652855 | 0.75 | PFKFB3 (0.36) | PFKFB3PFKFB1PFKFB2KDM4EALDH1A1 | |
| SCHEMBL21653300 | 0.75 | PTPN1 (0.54) | KDM4EALDH1A1NPC1HPGDRAB9A | |
| SCHEMBL21653189 | 0.74 | RAB9A (0.43) | KDM4EALDH1A1CYP3A4CYP2C9CYP2C19 |
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-2020023657-A1 | PYRIDIN-2-ONE COMPOUNDS USEFUL AS SMARCA2 ANTAGONISTS | Epizyme, Inc. (US) | 2020-01-30 | — | — | WO | disclosed |