Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABBR2 | O75899 | 2/20 | 0.50 |
| ▸ | GABBR1 | Q9UBS5 | 2/20 | 0.50 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | THPO | P40225 | 1/20 | 0.39 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.38 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.38 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.38 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | BLM | P54132 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11325746 | 0.80 | FOLH1 (0.53) | CYP1A2 | |
| SCHEMBL10694949 | 0.79 | GABBR2 (0.46) | GABBR2GABBR1GABRR1ALDH1A1CYP1A2 | |
| SCHEMBL10690985 | 0.77 | GABRR1 (0.41) | GABBR2GABBR1GABRR1ALDH1A1GRIN2D | |
| SCHEMBL9461470 | 0.75 | FOLH1 (0.47) | TSHRLMNABLM | |
| SCHEMBL11328789 | 0.73 | FOLH1 (0.39) | GABRR1CYP1A2 | |
| SCHEMBL9715231 | 0.73 | FDPS (0.44) | GABBR2GABBR1GABRR1 | |
| SCHEMBL10587263 | 0.71 | GABBR2 (0.54) | GABBR2GABBR1GABRR1CYP1A2TSHR | |
| SCHEMBL10695619 | 0.71 | LAP3 (0.49) | — | |
| SCHEMBL6882285 | 0.70 | FOLH1 (0.61) | GABBR2GABBR1GABRR1ALDH1A1GRIN2D | |
| SCHEMBL7621426 | 0.70 | GABRR1 (0.56) | GABBR2GABBR1GABRR1CYP1A2 |
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-0266978-A2 | Novel antibacterial agents and potentiators of carbapenem antibiotics | MERCK & CO. INC. (US) | 1988-05-11 | — | — | EP | disclosed |