Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | COPS5 | Q92905 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.42 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | CDC42 | P60953 | 1/20 | 0.42 |
| ▸ | RAC1 | P63000 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14587254 | 0.90 | HPGD (0.50) | KDM4ETHRBLMNAHPGDHTT | |
| Trifluoroacetic Acid SCHEMBL5639104 | 0.81 | HPGD (0.47) | LMNAHPGDHTTKMT2AALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL5637557 | 0.81 | HPGD (0.47) | LMNAHPGDHTTKMT2AALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL5639310 | 0.80 | ALOX5AP (0.41) | KDM4ELMNAHPGDKMT2AALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL5639157 | 0.78 | DPP4 (0.47) | LMNAHPGDHTTKMT2APTGS2 | |
| Trifluoroacetic Acid SCHEMBL5637599 | 0.76 | HPGD (0.43) | KDM4ETHRBLMNAHPGDKMT2A | |
| Trifluoroacetic Acid SCHEMBL5636812 | 0.73 | HPGD (0.51) | KDM4EHPGDHTTKMT2AALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL5639539 | 0.72 | HPGD (0.44) | LMNAHPGDHTTKMT2AALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL5639463 | 0.72 | HPGD (0.44) | LMNAHPGDHTTKMT2AALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL5639221 | 0.71 | HPGD (0.41) | LMNAHPGDHTTKMT2AALDH1A1 |
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 |