Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PRKDC | P78527 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | GAA | P10253 | 4/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | SUV39H2 | Q9H5I1 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19622260 | 0.85 | CTSC (0.38) | ALDH1A1MAPTSMN1; SMN2KDM4EGAA | |
| SCHEMBL14748436 | 0.78 | PRKDC (0.43) | ALDH1A1MAPTPRKDCSMN1; SMN2KDM4E | |
| SCHEMBL2230778 | 0.69 | MEN1 (0.37) | ALDH1A1MAPTSMN1; SMN2KDM4EL3MBTL1 | |
| SCHEMBL4253285 | 0.66 | PRKDC (0.75) | ALDH1A1MAPTPRKDCSMN1; SMN2KDM4E | |
| SCHEMBL30762471 | 0.64 | KDM4E (0.44) | ALDH1A1MAPTSMN1; SMN2KDM4EGAA | |
| SCHEMBL25928125 | 0.64 | OGA (0.50) | ALDH1A1MAPTL3MBTL1TDP1CYP1A2 | |
| SCHEMBL30762431 | 0.64 | KDM4E (0.46) | ALDH1A1MAPTSMN1; SMN2KDM4EGAA | |
| SCHEMBL19622259 | 0.63 | LMNA (0.41) | ALDH1A1MAPTPRKDCSMN1; SMN2GAA | |
| SCHEMBL9996944 | 0.63 | L3MBTL1 (0.44) | ALDH1A1MAPTSMN1; SMN2KDM4EGAA | |
| SCHEMBL30762624 | 0.63 | NPSR1 (0.44) | ALDH1A1MAPTSMN1; SMN2KDM4EGAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-2564857-A1 | Boron-containing small molecules as anti-inflammatory agents | Anacor Pharmaceuticals, Inc. (US) | 2013-03-06 | — | — | EP | disclosed |