Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 7/20 | 0.53 |
| ▸ | CES2 | O00748 | 1/20 | 0.46 |
| ▸ | CES1 | P23141 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | HTR7 | P34969 | 1/20 | 0.46 |
| ▸ | HTR6 | P50406 | 1/20 | 0.46 |
| ▸ | MGLL | Q99685 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7252645 | 0.98 | HSD11B1 (0.51) | HSD11B1CES2CES1HTR2AHTR2C | |
| SCHEMBL9906276 | 0.85 | CHRNB2 (0.50) | HSD11B1HTR2AHTR2CHTR7HTR6 | |
| SCHEMBL2994309 | 0.85 | CHRNB2 (0.50) | HSD11B1HTR2AHTR2CHTR7HTR6 | |
| SCHEMBL2146518 | 0.85 | MEN1 (0.54) | HSD11B1HTR2AHTR2CHTR7HTR6 | |
| Hydrochloric Acid SCHEMBL5478246 | 0.84 | MEN1 (0.57) | HSD11B1HTR2AHTR2CHTR7HTR6 | |
| Hydrochloric Acid SCHEMBL5478248 | 0.84 | MEN1 (0.57) | HSD11B1HTR2AHTR2CHTR7HTR6 | |
| SCHEMBL2994939 | 0.84 | CHRNB2 (0.51) | HSD11B1HTR2AHTR2CHTR7HTR6 | |
| SCHEMBL2323451 | 0.83 | HSD11B1 (0.49) | HSD11B1HTR2AHTR2CHTR7HTR6 | |
| Hydrochloric Acid SCHEMBL5478791 | 0.81 | HSD11B1 (0.48) | HSD11B1HTR2AHTR2CHTR7HTR6 | |
| SCHEMBL31164032 | 0.81 | HSD11B1 (0.68) | HSD11B1HTR2AHTR2CHTR7HTR6 |
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-5198449-A | N-substituted alpha-arylazacycloalkylmethanamines and their use as cardiovascular agents | A. H. ROBINS COMPANY INCORPORATED (US) | 1993-03-30 | — | — | US | disclosed |