Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 5/20 | 0.43 |
| ▸ | DYRK1A | Q13627 | 5/20 | 0.43 |
| ▸ | NPC1 | O15118 | 5/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | LDHA | P00338 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13201376 | 0.86 | LDHA (0.55) | APPRAB9ADYRK1ANPC1CYP1A2 | |
| SCHEMBL15582913 | 0.77 | LCK (0.58) | RAB9ADYRK1ANPC1CYP1A2CYP3A4 | |
| SCHEMBL27958892 | 0.75 | GAA (0.63) | RAB9ADYRK1ANPC1CYP1A2CYP2C19 | |
| SCHEMBL16264444 | 0.74 | APP (0.49) | APPRAB9ADYRK1ANPC1CYP1A2 | |
| SCHEMBL1621668 | 0.73 | SMN1; SMN2 (0.61) | APPRAB9ANPC1LDHAMAPT | |
| SCHEMBL1094500 | 0.69 | APP (0.47) | APPRAB9ANPC1MAPTSMN1; SMN2 | |
| SCHEMBL369617 | 0.69 | KMT2A (0.51) | APPRAB9ADYRK1ANPC1MAPT | |
| SCHEMBL4830279 | 0.69 | RAB9A (0.61) | RAB9ANPC1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL19190176 | 0.69 | APP (0.44) | APPRAB9ADYRK1ANPC1CYP3A4 | |
| SCHEMBL21669065 | 0.69 | APP (0.48) | APPRAB9ADYRK1ANPC1CYP1A2 |
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-2571357-B1 | CHEMICAL COMPOUNDS, COMPOSITIONS AND METHODS FOR KINASE MODULATION | INFINITY PHARMACEUTICALS INC (US) | 2016-07-06 | — | — | EP | disclosed |