Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL22784325 | 0.92 | GRM1 (0.38) | CYP2C19GRM1CYP1A2USP2ALDH1A1 | |
| SCHEMBL28435415 | 0.79 | CYP2C19 (0.38) | CYP2C19GRM1CYP1A2USP2ALDH1A1 | |
| SCHEMBL7367053 | 0.79 | CHRM2 (0.34) | CYP1A2USP2ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL2419350 | 0.78 | CYP2D6 (0.34) | ALDH1A1 | |
| Hydrochloric Acid SCHEMBL2424160 | 0.77 | CYP2C19 (0.37) | CYP2C19GRM1CYP1A2USP2ALDH1A1 | |
| SCHEMBL2418813 | 0.75 | CHRM2 (0.31) | — | |
| SCHEMBL9696948 | 0.74 | — | — | |
| Bromide SCHEMBL9458205 | 0.74 | CHRM2 (0.30) | — | |
| SCHEMBL7434996 | 0.73 | — | — | |
| SCHEMBL10316921 | 0.72 | ALDH1A1 (0.44) | ALDH1A1 |
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-0287356-B1 | Bridgehead substituted azabicyclic derivatives | BEECHAM GROUP PLC (GB) | 1996-01-24 | — | — | EP | claimed |