Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.49 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.49 |
| ▸ | GCGR | P47871 | 2/20 | 0.38 |
| ▸ | USP7 | Q93009 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 2/20 | 0.35 |
| ▸ | CNR2 | P34972 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8926006 | 0.82 | ESR1 (0.57) | ESR1ESR2GCGRUSP7POLB | |
| SCHEMBL983995 | 0.77 | ESR1 (0.53) | ESR1ESR2GCGRUSP7POLB | |
| SCHEMBL983106 | 0.77 | ESR1 (0.53) | ESR1ESR2GCGRUSP7POLB | |
| SCHEMBL20658230 | 0.76 | ESR2 (0.51) | ESR1ESR2GCGRUSP7POLB | |
| SCHEMBL30294156 | 0.76 | ESR1 (0.51) | ESR1ESR2GCGRUSP7POLB | |
| SCHEMBL7702950 | 0.73 | ALDH1A1 (0.48) | ESR1ESR2SMN1; SMN2PDE4APDE4B | |
| SCHEMBL10614412 | 0.73 | ALDH1A1 (0.48) | ESR1ESR2POLBRECQLSMN1; SMN2 | |
| SCHEMBL27727021 | 0.72 | ESR1 (0.37) | ESR1ESR2GCGRUSP7SMN1; SMN2 | |
| SCHEMBL2204310 | 0.72 | ESR1 (0.42) | ESR1ESR2CNR1CNR2ALDH1A1 | |
| SCHEMBL9251265 | 0.72 | USP7 (0.59) | ESR1ESR2USP7PDE4APDE4B |
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 |
|---|---|---|---|---|---|---|---|
| US-4362831-A | A HINDERED AND HETEROCYCLIC AMINE WITH A THIOALKANOIC ACID AMIDE | ADEKA ARGUS CHEMICAL CO., LTD. (JP) | 1982-12-07 | — | — | US | disclosed |