Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | KIF11 | P52732 | 6/20 | 0.40 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA5A | P35218 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6062610 | 0.75 | TAAR1 (0.52) | TAAR1TSHRKIF11KCNN4CYP1A2 | |
| SCHEMBL8954895 | 0.75 | TAAR1 (0.52) | TAAR1TSHRKIF11KCNN4LOXL2 | |
| SCHEMBL3667295 | 0.75 | TAAR1 (0.52) | TAAR1TSHRKIF11KCNN4CYP1A2 | |
| SCHEMBL19743378 | 0.74 | CYP1A2 (0.50) | TAAR1TSHRKIF11CYP1A2 | |
| SCHEMBL15125012 | 0.73 | HIF1A (0.55) | TSHRKIF11KCNN4CYP1A2CA1 | |
| SCHEMBL3046939 | 0.71 | TAAR1 (0.48) | TAAR1TSHRKIF11KCNN4CYP1A2 | |
| SCHEMBL1500477 | 0.71 | TSHR (0.58) | TAAR1TSHRKCNN4CYP1A2CA1 | |
| SCHEMBL10749002 | 0.70 | TAAR1 (0.52) | TAAR1TSHRKIF11KCNN4CA1 | |
| Hydrochloric Acid SCHEMBL6219522 | 0.70 | TAAR1 (0.46) | TAAR1TSHRKIF11KCNN4CYP1A2 | |
| SCHEMBL22609038 | 0.69 | TAAR1 (0.56) | TAAR1TSHRKIF11KCNN4LOXL2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011126960-A1 | OXAZOLE DERIVATIVES USEFUL AS MODULATORS OF FAAH | MERCK SHARP & DOHME CORP. (US) | 2011-10-13 | — | — | WO | disclosed |