Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.58 |
| ▸ | LMNA | P02545 | 4/20 | 0.58 |
| ▸ | HPGD | P15428 | 3/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.58 |
| ▸ | GAA | P10253 | 2/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.58 |
| ▸ | GLA | P06280 | 1/20 | 0.58 |
| ▸ | CASP1 | P29466 | 1/20 | 0.58 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.58 |
| ▸ | CASP7 | P55210 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16708105 | 0.85 | KDM4E (0.51) | ALDH1A1LMNAHPGDSMN1; SMN2KDM4E | |
| SCHEMBL11746037 | 0.84 | PIM1 (0.53) | ALDH1A1LMNAHPGDSMN1; SMN2KDM4E | |
| SCHEMBL20136031 | 0.80 | LMNA (0.62) | ALDH1A1LMNAHPGDSMN1; SMN2KDM4E | |
| SCHEMBL20136038 | 0.78 | LMNA (0.56) | ALDH1A1LMNAHPGDSMN1; SMN2KDM4E | |
| SCHEMBL20135981 | 0.78 | LMNA (0.56) | ALDH1A1LMNAHPGDSMN1; SMN2KDM4E | |
| SCHEMBL13155417 | 0.77 | ALDH1A1 (0.54) | ALDH1A1LMNAHPGDSMN1; SMN2KDM4E | |
| SCHEMBL11684788 | 0.77 | ALDH1A1 (0.69) | ALDH1A1LMNAHPGDSMN1; SMN2KDM4E | |
| SCHEMBL16492619 | 0.77 | LMNA (0.57) | ALDH1A1LMNAHPGDSMN1; SMN2KDM4E | |
| SCHEMBL6001320 | 0.77 | ALDH1A1 (0.59) | ALDH1A1LMNAHPGDSMN1; SMN2KDM4E | |
| SCHEMBL20136020 | 0.76 | KDM4E (0.53) | ALDH1A1LMNAHPGDSMN1; SMN2KDM4E |
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-2828269-B1 | BORONIC ACID BEARING LIPHAGANE COMPOUNDS AS INHIBITORS OF PI3K-ALPHA AND/OR BETA | COUNCIL SCIENT IND RES (IN) | 2018-05-16 | — | — | EP | disclosed |