Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 6/20 | 0.45 |
| ▸ | CA2 | P00918 | 6/20 | 0.45 |
| ▸ | CA12 | O43570 | 4/20 | 0.45 |
| ▸ | CA9 | Q16790 | 4/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7272921 | 0.80 | TDP1 (0.56) | TDP1GAAPOLBNPSR1MAOA | |
| SCHEMBL14353177 | 0.80 | LMNA (0.49) | TDP1CA1CA2MAPTMEN1 | |
| SCHEMBL16264885 | 0.79 | TDP1 (0.55) | TDP1GAAPOLBNPSR1MAOA | |
| SCHEMBL917871 | 0.79 | TDP1 (0.54) | TDP1GAAPOLBNPSR1MAOA | |
| SCHEMBL31307113 | 0.79 | TDP1 (0.58) | TDP1GAAPOLBNPSR1MAOA | |
| SCHEMBL22102023 | 0.79 | NPSR1 (0.61) | TDP1GAAPOLBNPSR1CYP3A4 | |
| SCHEMBL5468072 | 0.79 | NPSR1 (0.61) | TDP1GAAPOLBNPSR1CYP3A4 | |
| SCHEMBL31307112 | 0.79 | TDP1 (0.54) | TDP1GAAPOLBNPSR1MAOA | |
| SCHEMBL937704 | 0.78 | TDP1 (0.53) | TDP1GAAPOLBNPSR1MAOA | |
| SCHEMBL938186 | 0.78 | CA1 (0.55) | TDP1GAAPOLBNPSR1MAOA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1838696-A1 | NOVEL CYANOGUANIDINE COMPOUNDS | Leo Pharma A/S (DK) | 2007-10-03 | — | — | EP | disclosed |
| WO-2006066584-A1 | NOVEL CYANOGUANIDINE COMPOUNDS | LEO PHARMA A/S (DK) | 2006-06-29 | — | — | WO | disclosed |