Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 4/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 5/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KCNK3 | O14649 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | HSD11B2 | P80365 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL5639539 | 1.00 | HPGD (0.44) | HPGDPOLBCYP3A4CYP2C19LMNA | |
| SCHEMBL14587256 | 0.89 | POLB (0.51) | HPGDPOLBLMNAHTTALDH1A1 | |
| SCHEMBL14587260 | 0.89 | POLB (0.51) | HPGDPOLBLMNAHTTALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL5637557 | 0.87 | HPGD (0.47) | HPGDPOLBCYP3A4CYP2C19LMNA | |
| Trifluoroacetic Acid SCHEMBL5639104 | 0.87 | HPGD (0.47) | HPGDPOLBCYP3A4CYP2C19LMNA | |
| Trifluoroacetic Acid SCHEMBL5639221 | 0.87 | HPGD (0.41) | HPGDPOLBCYP3A4CYP2C19LMNA | |
| Trifluoroacetic Acid SCHEMBL5635813 | 0.85 | HPGD (0.47) | HPGDPOLBCYP3A4CYP2C19LMNA | |
| Trifluoroacetic Acid SCHEMBL5637599 | 0.83 | HPGD (0.43) | HPGDPOLBCYP3A4CYP2C19LMNA | |
| Trifluoroacetic Acid SCHEMBL5639024 | 0.79 | ALOX5AP (0.41) | HPGDPOLBCYP3A4CYP2C19LMNA | |
| Trifluoroacetic Acid SCHEMBL5639310 | 0.79 | ALOX5AP (0.41) | HPGDPOLBCYP3A4CYP2C19LMNA |
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-7179802-B2 | 11-beta-hydroxysteroid dehydrogenase 1 inhibitors useful for the treatment of diabetes, obesity and dyslipidemia | MERCK & CO., INC. (US) | 2007-02-20 | — | — | US | disclosed |