Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.62 |
| ▸ | BCHE | P06276 | 3/20 | 0.62 |
| ▸ | ACHE | P22303 | 2/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.61 |
| ▸ | GAA | P10253 | 2/20 | 0.61 |
| ▸ | MEN1 | O00255 | 2/20 | 0.61 |
| ▸ | LMNA | P02545 | 1/20 | 0.61 |
| ▸ | TP53 | P04637 | 1/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | FAAH | O00519 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | THRB | P10828 | 1/20 | 0.51 |
| ▸ | GFER | P55789 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL1013517 | 0.91 | CYP1A2 (0.65) | KMT2ABCHEACHEALDH1A1GAA | |
| SCHEMBL27692841 | 0.88 | KMT2A (0.62) | KMT2ABCHEACHEALDH1A1GAA | |
| SCHEMBL12655119 | 0.84 | KMT2A (0.78) | KMT2ABCHEACHEALDH1A1GAA | |
| SCHEMBL13797610 | 0.83 | ALDH1A1 (0.70) | KMT2AALDH1A1GAAMEN1LMNA | |
| SCHEMBL18862216 | 0.82 | ALDH1A1 (0.58) | KMT2ABCHEACHEALDH1A1GAA | |
| SCHEMBL29358693 | 0.81 | ACHE (0.71) | BCHEACHEALDH1A1LMNAMAPT | |
| SCHEMBL5933261 | 0.81 | ACHE (0.71) | BCHEACHEALDH1A1LMNAMAPT | |
| SCHEMBL27360559 | 0.81 | ALDH1A1 (0.63) | KMT2ABCHEACHEALDH1A1GAA | |
| SCHEMBL28119215 | 0.81 | ACHE (0.51) | KMT2ABCHEACHEALDH1A1GAA | |
| SCHEMBL11382382 | 0.80 | ALDH1A1 (0.78) | KMT2ABCHEACHEALDH1A1GAA |
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 |
|---|---|---|---|---|---|---|---|
| US-8106031-B2 | Hydrolytically-resistant boron-containing therapeutics and methods of use | ANACOR PHARMACEUTICALS, INC. (US) | 2012-01-31 | — | — | US | disclosed |