Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 11/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | MAPT | P10636 | 5/20 | 0.46 |
| ▸ | HPGD | P15428 | 5/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.43 |
| ▸ | MEN1 | O00255 | 5/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | POLB | P06746 | 3/20 | 0.43 |
| ▸ | CTDSP1 | Q9GZU7 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| SCHEMBL9543555 | 0.85 | CYP1A2 (0.65) | KDM4ECYP1A2CYP2C9ALDH1A1MAPT | |
| SCHEMBL9539886 | 0.83 | KDM4E (0.54) | KDM4ECYP1A2CYP2C9ALDH1A1MAPT | |
| SCHEMBL10463716 | 0.75 | KDM4E (0.51) | KDM4ECYP1A2CYP2C9ALDH1A1MAPT | |
| SCHEMBL9542451 | 0.72 | MAPK1 (0.56) | KDM4ECYP1A2CYP2C9ALDH1A1MAPT | |
| SCHEMBL3445304 | 0.71 | MAPT (0.42) | KDM4EALDH1A1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL7331553 | 0.70 | KDM4E (0.51) | KDM4ECYP1A2CYP2C9ALDH1A1MAPT | |
| SCHEMBL10464594 | 0.69 | KDM4E (0.47) | KDM4ECYP1A2CYP2C9ALDH1A1MAPT | |
| SCHEMBL13317085 | 0.69 | KDM4E (0.60) | KDM4ECYP1A2CYP2C9ALDH1A1MAPT | |
| SCHEMBL10931099 | 0.68 | EGFR (0.51) | KDM4ECYP1A2CYP2C9ALDH1A1MAPT | |
| SCHEMBL2922603 | 0.68 | GAA (0.53) | KDM4ECYP1A2ALDH1A1MAPTSMN1; SMN2 |
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-1993013664-A2 | BIHETEROCYCLIC FUNGICIDAL COMPOUNDS | SCHERING AGROCHEMICALS LIMITED (GB) | 1993-07-22 | — | — | WO | disclosed |