Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | SNCA | P37840 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | RHOA | P61586 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2324062 | 0.80 | ALDH1A1 (0.67) | ALDH1A1HSD17B10TSHRMEN1KMT2A | |
| SCHEMBL18343704 | 0.72 | BTK (0.43) | ALDH1A1TSHRMEN1KMT2A | |
| SCHEMBL535662 | 0.72 | ALDH1A1 (0.39) | ALDH1A1TSHRMEN1KMT2AKDM4E | |
| SCHEMBL7563230 | 0.71 | CYP3A4 (0.72) | CYP3A4ALDH1A1HSD17B10TSHRMEN1 | |
| SCHEMBL209680 | 0.69 | CYP3A4 (0.70) | CYP3A4ALDH1A1HSD17B10TSHRMEN1 | |
| SCHEMBL23301502 | 0.69 | ALDH1A1 (0.63) | CYP3A4ALDH1A1HSD17B10TSHRMEN1 | |
| SCHEMBL4590773 | 0.68 | ALDH1A1 (0.54) | CYP3A4ALDH1A1HSD17B10TSHRMEN1 | |
| SCHEMBL4566407 | 0.67 | SNCA (0.48) | CYP3A4ALDH1A1HSD17B10TSHRMEN1 | |
| SCHEMBL8019431 | 0.67 | CYP3A4 (0.66) | CYP3A4ALDH1A1HSD17B10TSHRMEN1 | |
| SCHEMBL29362146 | 0.67 | CYP3A4 (1.00) | CYP3A4ALDH1A1HSD17B10TSHRMEN1 |
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-2356117-A1 | PYRAZOLOPYRIDINE PI3K INHIBITOR COMPOUNDS AND METHODS OF USE | Genentech, Inc. (US) | 2011-08-17 | — | — | EP | disclosed |
| WO-2010059788-A1 | PYRAZOLOPYRIDINE PI3K INHIBITOR COMPOUNDS AND METHODS OF USE | GENENTECH, INC. (US) | 2010-05-27 | — | — | WO | disclosed |