Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.30 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.30 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL13885275 | 0.85 | HDAC4 (0.40) | ESR1ESR2SLC6A4SLC6A3HDAC4 | |
| SCHEMBL1501263 | 0.79 | ESR2 (0.48) | ESR1ESR2SLC6A4SLC6A3KMT2A | |
| SCHEMBL30132903 | 0.78 | ESR2 (0.50) | ESR1ESR2SLC6A4SLC6A3OPRM1 | |
| SCHEMBL399985 | 0.76 | ESR2 (0.40) | ESR1ESR2SLC6A4SLC6A3 | |
| SCHEMBL398965 | 0.75 | ESR2 (0.41) | ESR1ESR2SLC6A4SLC6A3 | |
| SCHEMBL10899121 | 0.73 | ESR2 (0.44) | ESR1ESR2SLC6A4SLC6A3OPRM1 | |
| SCHEMBL398267 | 0.71 | RXRA (0.41) | ESR1ESR2OPRM1OPRD1OPRK1 | |
| SCHEMBL1629047 | 0.70 | ESR1 (0.36) | ESR1ESR2SLC6A4MEN1SLC6A2 | |
| SCHEMBL401350 | 0.70 | RXRA (0.41) | ESR1ESR2OPRM1OPRD1OPRK1 | |
| SCHEMBL15436406 | 0.69 | HDAC4 (0.38) | ESR1ESR2SLC6A4SLC6A3HDAC4 |
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-2200994-B1 | CONDENSED COMPOUNDS WITH ACTIVITY AT ESTROGEN RECEPTORS | ACADIA PHARM INC (US) | 2014-01-22 | — | — | EP | disclosed |