Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | JAK1 | P23458 | 1/20 | 0.35 |
| ▸ | TYK2 | P29597 | 1/20 | 0.35 |
| ▸ | JAK3 | P52333 | 1/20 | 0.35 |
| ▸ | ABL1 | P00519 | 1/20 | 0.35 |
| ▸ | BCR | P11274 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | ACACB | O00763 | 1/20 | 0.35 |
| ▸ | ACACA | Q13085 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | F2 | P00734 | 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 | |
|---|---|---|---|---|
| SCHEMBL11901980 | 0.91 | SMN1; SMN2 (0.39) | KDM4EALDH1A1GAAHTTSMN1; SMN2 | |
| SCHEMBL12472196 | 0.82 | JAK2 (0.37) | KDM4EALDH1A1GAAHTTSMN1; SMN2 | |
| SCHEMBL11901372 | 0.79 | HRH3 (0.36) | KDM4EALDH1A1GAAHTTSMN1; SMN2 | |
| SCHEMBL12683053 | 0.79 | PIK3CD (0.46) | — | |
| SCHEMBL11902218 | 0.77 | PIK3CD (0.39) | JAK2JAK1TYK2JAK3 | |
| SCHEMBL11902468 | 0.76 | PIK3CD (0.58) | — | |
| SCHEMBL11901829 | 0.74 | PIK3CD (0.47) | — | |
| SCHEMBL11964483 | 0.74 | ALDH1A1 (0.42) | KDM4EALDH1A1GAAHTTSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL11901494 | 0.73 | ALDH1A1 (0.41) | KDM4EALDH1A1GAAHTTSMN1; SMN2 | |
| SCHEMBL11900736 | 0.70 | CYP11B2 (0.38) | JAK2JAK1TYK2JAK3ABL1 |
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-2012107465-A1 | HETEROCYCLIC COMPOUNDS AS PI3 KINASE INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2012-08-16 | — | — | WO | disclosed |