Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.50 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.50 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 13/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 8/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 7/20 | 0.36 |
| ▸ | HTR2A | P28223 | 5/20 | 0.35 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 2/20 | 0.31 |
| ▸ | DPP4 | P27487 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8993553 | 0.85 | ESR1 (0.52) | ESR1ESR2CYP3A4CYP2D6TSHR | |
| SCHEMBL9630764 | 0.80 | POLB (0.50) | ESR1ESR2SLC6A4CYP3A4KCNH2 | |
| SCHEMBL9846972 | 0.79 | ESR1 (0.51) | ESR1ESR2SLC6A4SLC6A2CYP3A4 | |
| SCHEMBL10000525 | 0.74 | ESR1 (0.66) | ESR1ESR2TSHR | |
| SCHEMBL827205 | 0.73 | ESR1 (0.69) | ESR1ESR2CYP3A4CYP2D6TSHR | |
| SCHEMBL9847013 | 0.73 | HRH1 (0.45) | ESR1ESR2HRH1SLC6A4SLC6A2 | |
| SCHEMBL9472412 | 0.72 | ESR1 (0.67) | ESR1ESR2CYP3A4CYP2D6TSHR | |
| SCHEMBL19766172 | 0.71 | ESR1 (0.61) | ESR1ESR2SLC6A2SLC6A3CYP3A4 | |
| SCHEMBL6335156 | 0.71 | ESR1 (0.57) | ESR1ESR2CYP3A4CYP2D6TSHR | |
| SCHEMBL22003016 | 0.71 | ESR1 (0.57) | ESR1ESR2CYP3A4CYP2D6TSHR |
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-0413233-A2 | Copolyamides with higher glas transition temperature | BAYER AG (DE) | 1991-02-20 | — | — | EP | disclosed |