Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.37 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.37 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.35 |
| ▸ | KCND3 | Q9UK17 | 1/20 | 0.35 |
| ▸ | P4HB | P07237 | 1/20 | 0.35 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.35 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4707557 | 1.00 | CYP19A1 (0.38) | CYP19A1HSP90AA1KDM4ES1PR1S1PR3 | |
| SCHEMBL4706109 | 0.84 | SMN1; SMN2 (0.47) | KDM4EALDH1A1LMNAMAPTSMN1; SMN2 | |
| SCHEMBL4182229 | 0.83 | FAAH (0.43) | ALDH1A1LMNAMAPTHTTSMN1; SMN2 | |
| SCHEMBL4705649 | 0.83 | KCNA5 (0.48) | ALDH1A1MAPTSMN1; SMN2L3MBTL1S1PR4 | |
| SCHEMBL4707217 | 0.78 | CYP2C19 (0.45) | CYP19A1HSP90AA1KDM4ES1PR1ALDH1A1 | |
| SCHEMBL14033360 | 0.78 | L3MBTL1 (0.48) | HSP90AA1KDM4EALDH1A1LMNAMAPT | |
| SCHEMBL14033102 | 0.78 | HSP90AA1 (0.47) | HSP90AA1KDM4ELMNAMAPTHTT | |
| SCHEMBL18322302 | 0.77 | S1PR3 (0.42) | CYP19A1S1PR1S1PR3ALDH1A1LMNA | |
| SCHEMBL30489175 | 0.77 | S1PR3 (0.42) | CYP19A1S1PR1S1PR3ALDH1A1LMNA | |
| SCHEMBL30251313 | 0.76 | ALDH1A1 (0.40) | CYP19A1HSP90AA1S1PR1S1PR3ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107787322-B | Tricyclic compounds and their use as phosphodiesterase inhibitors | 辉瑞大药厂 | 2023-07-07 | — | — | CN | disclosed |