Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 2/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 3/20 | 0.31 |
| ▸ | CFTR | P13569 | 1/20 | 0.31 |
| ▸ | AURKA | O14965 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.30 |
| ▸ | ADRB1 | P08588 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5346025 | 0.99 | HSD11B1 (0.35) | HSD11B1PIM1ACHECFTRAURKA | |
| SCHEMBL5343256 | 0.91 | CHRM2 (0.35) | HSD11B1 | |
| Hydrochloric Acid SCHEMBL5343688 | 0.90 | CHRM2 (0.35) | HSD11B1 | |
| SCHEMBL5347690 | 0.80 | HSD11B1 (0.36) | HSD11B1ACHE | |
| Hydrochloric Acid SCHEMBL5346017 | 0.79 | HSD11B1 (0.36) | HSD11B1ACHE | |
| SCHEMBL5343241 | 0.71 | CHRM2 (0.41) | HSD11B1ACHE | |
| Hydrochloric Acid SCHEMBL5344037 | 0.70 | MAPT (0.34) | — | |
| SCHEMBL2472859 | 0.68 | SLC18A3 (0.41) | ADRB1 | |
| SCHEMBL5350943 | 0.68 | KCNH2 (0.44) | ADRB1 | |
| Hydrochloric Acid SCHEMBL5339938 | 0.68 | CYP2D6 (0.40) | AURKA |
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-7208495-B2 | Benzo-fused 5-membered hetrocycle compounds, process for preparation of the same, and use thereof | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-04-24 | — | — | US | claimed |