Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 3/20 | 0.40 |
| ▸ | DRD4 | P21917 | 2/20 | 0.40 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | GLA | P06280 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | GMNN | O75496 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL13889887 | 0.85 | GAA (0.42) | GAAMAPTKDM4EALDH1A1CYP1A2 | |
| SCHEMBL13202969 | 0.85 | GAA (0.62) | GAAMAPTESR2ESR1DRD2 | |
| Hydrochloric Acid SCHEMBL10909135 | 0.83 | GAA (0.60) | GAAMAPTESR2ESR1DRD2 | |
| SCHEMBL17454452 | 0.82 | GAA (0.42) | GAAMAPTBRD4MEN1KMT2A | |
| SCHEMBL6254771 | 0.82 | MAPT (0.42) | GAAMAPTBRD4MEN1KMT2A | |
| SCHEMBL7144285 | 0.82 | GAA (0.42) | GAAMAPTKMT2ALMNAHSP90AA1 | |
| SCHEMBL7837151 | 0.80 | ESR2 (0.42) | GAAMAPTESR2ESR1DRD2 | |
| SCHEMBL10909269 | 0.79 | GAA (0.40) | GAAMAPTESR2ESR1MEN1 | |
| SCHEMBL8284981 | 0.77 | GAA (0.71) | GAAMAPTBRD4CREBBPTSHR | |
| SCHEMBL16523130 | 0.77 | GAA (0.71) | GAAMAPTBRD4CREBBPTSHR |
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-1581514-A2 | CHEMICAL COMPOUNDS | SmithKline Beecham Corporation (US) | 2005-10-05 | — | — | EP | disclosed |
| WO-2004043379-A2 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2004-05-27 | — | — | WO | disclosed |