Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR6 | P46095 | 5/20 | 0.33 |
| ▸ | DPP4 | P27487 | 2/20 | 0.33 |
| ▸ | DPP7 | Q9UHL4 | 2/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.33 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.32 |
| ▸ | TACR2 | P21452 | 1/20 | 0.32 |
| ▸ | TACR1 | P25103 | 1/20 | 0.32 |
| ▸ | TACR3 | P29371 | 1/20 | 0.32 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
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 SCHEMBL314381 | 1.00 | GPR6 (0.33) | GPR6DPP4DPP7TRPV1SLC2A1 | |
| SCHEMBL314816 | 0.91 | HSD11B1 (0.37) | BRD4BCHEHSD11B1 | |
| SCHEMBL315207 | 0.91 | HSD11B1 (0.37) | BRD4BCHEHSD11B1 | |
| SCHEMBL315208 | 0.91 | HSD11B1 (0.37) | BRD4BCHEHSD11B1 | |
| Trifluoroacetic Acid SCHEMBL314788 | 0.84 | TNKS2 (0.42) | GPR6TNKS2TACR2TACR1TACR3 | |
| SCHEMBL314431 | 0.83 | HSD11B1 (0.37) | BRD4AVPR1ABCHEHSD11B1 | |
| SCHEMBL314433 | 0.83 | HSD11B1 (0.37) | BRD4AVPR1ABCHEHSD11B1 | |
| SCHEMBL314432 | 0.83 | HSD11B1 (0.37) | BRD4AVPR1ABCHEHSD11B1 | |
| Trifluoroacetic Acid SCHEMBL314138 | 0.82 | ALDH1A1 (0.42) | GPR6BRD4 | |
| Trifluoroacetic Acid SCHEMBL314137 | 0.82 | ALDH1A1 (0.42) | GPR6BRD4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8093240-B2 | Triazole derivatives | MERCK PATENT GMBH (DE) | 2012-01-10 | — | — | US | disclosed |
| EP-2322527-A1 | Triazole derivatives | Merck Patent GmbH (DE) | 2011-05-18 | — | — | EP | disclosed |