Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | PDE4A | P27815 | 1/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.54 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.54 |
| ▸ | ACACB | O00763 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.45 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL7905684 | 0.86 | SMN1; SMN2 (0.55) | KDM4ESMN1; SMN2CYP1A2CYP2D6PDE4A | |
| SCHEMBL7913801 | 0.85 | SMN1; SMN2 (0.54) | KDM4ESMN1; SMN2CYP1A2CYP2D6PDE4A | |
| SCHEMBL7919550 | 0.84 | KDM4E (0.52) | KDM4ESMN1; SMN2CYP1A2CYP2D6PDE4A | |
| SCHEMBL7916079 | 0.83 | SMN1; SMN2 (0.57) | KDM4ESMN1; SMN2CYP1A2CYP2D6PDE4A | |
| SCHEMBL7905681 | 0.82 | HTT (0.71) | SMN1; SMN2ALDH1A1LMNAHTTMAPT | |
| SCHEMBL874241 | 0.82 | POLB (0.54) | KDM4ESMN1; SMN2CYP1A2CYP2D6PDE4A | |
| SCHEMBL7917566 | 0.81 | ALDH1A1 (0.55) | KDM4ESMN1; SMN2CYP1A2CYP2D6PDE4A | |
| SCHEMBL10076459 | 0.81 | ALDH1A1 (0.55) | KDM4ESMN1; SMN2CYP1A2CYP2D6PDE4A | |
| SCHEMBL7915995 | 0.81 | KDM4E (0.52) | KDM4ESMN1; SMN2CYP1A2CYP2D6PDE4A | |
| SCHEMBL7915934 | 0.80 | MAPT (0.59) | KDM4ESMN1; SMN2ACACBALDH1A1HTT |
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-2010048340-A2 | NOVEL SEMI-SYNTHETIC GLYCOPEPTIDES AS ANTIBACTERIAL AGENTS | LEAD THERAPEUTICS, INC. (US) | 2010-04-29 | — | — | WO | disclosed |