Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 11/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CTSL | P07711 | 1/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 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 | |
|---|---|---|---|---|
| SCHEMBL5121986 | 0.95 | ESR1 (0.47) | ESR1GAARXFP1SMN1; SMN2KMT2A | |
| SCHEMBL7175621 | 0.89 | GAA (0.47) | ESR1GAARXFP1SMN1; SMN2KMT2A | |
| SCHEMBL7176456 | 0.89 | PDE5A (0.46) | ESR1CHRM4 | |
| SCHEMBL5128673 | 0.86 | GAA (0.50) | ESR1GAARXFP1SMN1; SMN2KMT2A | |
| SCHEMBL7176321 | 0.86 | CHRM4 (0.44) | ESR1SMN1; SMN2KMT2ACHRM4 | |
| SCHEMBL7170030 | 0.85 | ESR1 (0.47) | ESR1GAARXFP1SMN1; SMN2KMT2A | |
| SCHEMBL7176322 | 0.85 | TSHR (0.45) | ESR1GAATSHRSMN1; SMN2KMT2A | |
| SCHEMBL5118517 | 0.83 | BCDIN3D (0.48) | ESR1CHRM4 | |
| SCHEMBL5808078 | 0.83 | CHRM4 (0.45) | ESR1TSHRSMN1; SMN2KMT2ACHRM4 | |
| SCHEMBL5809171 | 0.83 | PRKCI (0.48) | — |
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-0920431-B1 | THIENOPYRIMIDINES | MERCK PATENT GMBH (DE) | 2003-02-26 | — | — | EP | disclosed |