Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 6/20 | 0.54 |
| ▸ | MAPT | P10636 | 5/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | IDO1 | P14902 | 1/20 | 0.53 |
| ▸ | PDE7A | Q13946 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.50 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.50 |
| ▸ | PDE7B | Q9NP56 | 1/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | GFER | P55789 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL16702465 | 0.84 | PDE7A (0.55) | MAPTALDH1A1PDE7AMEN1KMT2A | |
| SCHEMBL8881808 | 0.78 | MAPT (0.58) | LMNAMAPTALDH1A1IDO1PDE7A | |
| SCHEMBL2959825 | 0.78 | MAPT (0.71) | LMNAMAPTALDH1A1IDO1PDE7A | |
| SCHEMBL31354776 | 0.77 | CA12 (0.46) | MAPTALDH1A1PDE7AMEN1KMT2A | |
| SCHEMBL1137534 | 0.77 | ALDH1A1 (0.47) | LMNAMAPTALDH1A1PDE7AMEN1 | |
| SCHEMBL16702240 | 0.74 | GSTP1 (0.49) | MAPTALDH1A1PDE7AMEN1KMT2A | |
| SCHEMBL8757145 | 0.74 | MAPT (0.45) | LMNAMAPTALDH1A1PDE7AMEN1 | |
| SCHEMBL7228444 | 0.73 | PDE7A (0.39) | LMNAMAPTALDH1A1PDE7AMEN1 | |
| SCHEMBL7228251 | 0.73 | CYP1A2 (0.41) | LMNAMAPTALDH1A1PDE7AMEN1 | |
| SCHEMBL16702882 | 0.73 | ALDH1A1 (0.46) | MAPTALDH1A1PDE7AMEN1KMT2A |
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-102807574-B | New pyridine sulphur nitrogen seven-membered ring derivative as antitumor drug, and its preparation method and application | CHANGCHUN DISCOVERY SCIENCES, LTD. (CN) | 2015-09-02 | — | — | CN | disclosed |