Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 8/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6972453 | 0.87 | ALDH1A1 (0.45) | ALDH1A1TSHRNPC1ABCB1 | |
| SCHEMBL12112020 | 0.86 | ALDH1A1 (0.44) | ALDH1A1TSHRNPC1KMT2AABCB1 | |
| SCHEMBL12111919 | 0.86 | ALDH1A1 (0.44) | ALDH1A1TSHRNPC1KMT2AABCB1 | |
| SCHEMBL10147725 | 0.84 | ALDH1A1 (0.43) | ALDH1A1TSHRNPC1ABCB1 | |
| SCHEMBL10148068 | 0.84 | ALDH1A1 (0.43) | ALDH1A1TSHRNPC1ABCB1 | |
| SCHEMBL4284935 | 0.84 | ALDH1A1 (0.43) | ALDH1A1NPC1POLBMEN1USP2 | |
| SCHEMBL20557502 | 0.82 | ALDH1A1 (0.45) | ALDH1A1TSHRNPC1KMT2AABCB1 | |
| SCHEMBL16576324 | 0.82 | ALDH1A1 (0.45) | ALDH1A1TSHRNPC1KMT2AABCB1 | |
| SCHEMBL29324933 | 0.82 | ALDH1A1 (0.45) | ALDH1A1TSHRNPC1KMT2AABCB1 | |
| SCHEMBL27087661 | 0.82 | ALDH1A1 (0.45) | ALDH1A1TSHRNPC1KMT2AABCB1 |
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-2561872-A1 | 3, 5-disubstituted and 3,5,7-trisubstituted-3H-oxazolo [4,5-d]pyrimidin-2-one compounds and prodrugs thereof | Anadys Pharmaceuticals, Inc. (US) | 2013-02-27 | — | — | EP | disclosed |