Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 6/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | PDE4A | P27815 | 2/20 | 0.44 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.44 |
| ▸ | TACR1 | P25103 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | JAK1 | P23458 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL31449856 | 0.87 | TSHR (0.45) | ALDH1A1KDM4EGAATACR1MEN1 | |
| SCHEMBL23982323 | 0.86 | PDE4B (0.52) | PDE4BALDH1A1KDM4ETACR1MEN1 | |
| SCHEMBL12647197 | 0.84 | TACR1 (0.58) | TACR1GPR119 | |
| SCHEMBL4790687 | 0.84 | TACR1 (0.58) | TACR1GPR119 | |
| SCHEMBL2240106 | 0.84 | TACR1 (0.58) | TACR1GPR119 | |
| SCHEMBL14934668 | 0.82 | ALDH1A1 (0.50) | PDE4BALDH1A1KDM4EGAAPDE4A | |
| SCHEMBL18586188 | 0.82 | ALDH1A1 (0.50) | PDE4BALDH1A1KDM4EGAAPDE4A | |
| SCHEMBL16141380 | 0.82 | ALDH1A1 (0.50) | PDE4BALDH1A1KDM4EGAAPDE4A | |
| SCHEMBL14920417 | 0.82 | ALDH1A1 (0.50) | PDE4BALDH1A1KDM4EGAAPDE4A | |
| SCHEMBL14920416 | 0.82 | ALDH1A1 (0.50) | PDE4BALDH1A1KDM4EGAAPDE4A |
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-2022204150-A1 | COMPOUNDS AND COMPOSITIONS FOR TREATING CNS DISORDERS | BLUE OAK PHARMACEUTICALS, INC. (US) | 2022-09-29 | — | — | WO | disclosed |