Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | CA4 | P22748 | 1/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 5/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2729617 | 0.70 | TDP1 (0.38) | GAAKMT2ANPC1KDM4EALDH1A1 | |
| SCHEMBL2720197 | 0.70 | RAD52 (0.46) | MAPTRAB9ANPC1KDM4EALDH1A1 | |
| SCHEMBL3242823 | 0.68 | MAPT (0.57) | MAPTRAB9AGAAMEN1KMT2A | |
| SCHEMBL7244105 | 0.66 | MAPT (0.55) | MAPTRAB9AGAAMEN1KMT2A | |
| SCHEMBL6699936 | 0.65 | GLS (0.71) | CA9MAPTRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL2187848 | 0.64 | CASP3 (0.65) | CA1CA2CA9CA4CYP1B1 | |
| SCHEMBL34464362 | 0.64 | CASP3 (0.65) | CA1CA2CA9CA4CYP1B1 | |
| SCHEMBL8561131 | 0.63 | MAPT (0.55) | CYP1B1MAPTRAB9AGAAMEN1 | |
| SCHEMBL29724090 | 0.63 | CASP3 (0.86) | CA1CA2CA9CA4CYP1B1 | |
| SCHEMBL1142116 | 0.63 | CASP3 (0.86) | CA1CA2CA9CA4CYP1B1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2635565-A1 | 5 -CYANO-4, 6 -DIAMINOPYRIMIDINE OR 6 -AMINOPURINE DERIVATIVES AS PI3K- DELTA INHIBITORS | Amgen Inc. (US) | 2013-09-11 | — | — | EP | disclosed |
| WO-2012061696-A1 | 5 -CYANO-4, 6 -DIAMINOPYRIMIDINE OR 6 -AMINOPURINE DERIVATIVES AS PI3K- DELTA INHIBITORS | AMGEN INC. (US) | 2012-05-10 | — | — | WO | disclosed |