Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.57 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.57 |
| ▸ | POLB | P06746 | 2/20 | 0.56 |
| ▸ | GAA | P10253 | 3/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11894104 | 0.85 | POLB (0.77) | ALDH1A1ADORA3POLBGAATSHR | |
| SCHEMBL5775105 | 0.85 | ALDH1A1 (0.59) | ALDH1A1POLBGAATSHRHTT | |
| SCHEMBL3928735 | 0.82 | TSHR (0.56) | ALDH1A1ADORA3GAATSHRHTT | |
| SCHEMBL4683450 | 0.81 | PTGS1 (0.73) | ALDH1A1POLBGAATSHRHTT | |
| SCHEMBL11893412 | 0.79 | ALDH1A1 (0.72) | ALDH1A1POLBGAATSHRHTT | |
| SCHEMBL13734171 | 0.77 | GPBAR1 (0.58) | ALDH1A1POLBGAATSHRHTT | |
| SCHEMBL13733697 | 0.77 | HSD17B10 (0.71) | ALDH1A1POLBTSHRMEN1KMT2A | |
| SCHEMBL5773636 | 0.77 | GPBAR1 (0.57) | ALDH1A1POLBTSHRMEN1KMT2A | |
| SCHEMBL11893877 | 0.76 | ALDH1A1 (0.61) | ALDH1A1POLBGAATSHRHTT | |
| SCHEMBL4721200 | 0.76 | LMNA (0.72) | ALDH1A1POLBGAATSHRPTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009010784-A1 | NEW COMPOUNDS 955 | ASTRAZENECA AB (SE) | 2009-01-22 | — | — | WO | disclosed |
| WO-2009010784-A1 | NEW COMPOUNDS 955 | ASTRAZENECA AB (SE) | 2009-01-22 | — | — | WO | disclosed |