Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 3/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | F13A1 | P00488 | 1/20 | 0.36 |
| ▸ | TGM2 | P21980 | 1/20 | 0.36 |
| ▸ | TGM1 | P22735 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | BUB1 | O43683 | 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 | |
|---|---|---|---|---|
| SCHEMBL5939603 | 0.85 | CHRM2 (0.41) | ARCHRM2CHRM1CHRM3HSD11B1 | |
| SCHEMBL5938471 | 0.83 | NPC1 (0.40) | CHRM2CHRM1CHRM3NPC1ALDH1A1 | |
| SCHEMBL30959549 | 0.83 | NPC1 (0.40) | CHRM2CHRM1CHRM3NPC1ALDH1A1 | |
| SCHEMBL5940111 | 0.81 | NPC1 (0.46) | HSD11B1NPC1ALDH1A1SMN1; SMN2HSD17B10 | |
| SCHEMBL20627835 | 0.76 | CHRM2 (0.39) | ARCHRM2CHRM1CHRM3HSD11B1 | |
| SCHEMBL5938021 | 0.75 | NR1H2 (0.40) | ARCHRM2CHRM1CHRM3HSD11B1 | |
| SCHEMBL19868987 | 0.75 | HSD11B1 (0.40) | ARCHRM2CHRM1CHRM3HSD11B1 | |
| SCHEMBL6418166 | 0.74 | NR1H2 (0.43) | CHRM2CHRM1CHRM3HSD11B1NR1H2 | |
| SCHEMBL1691937 | 0.73 | HSD11B1 (0.40) | CHRM2CHRM1CHRM3HSD11B1NPC1 | |
| SCHEMBL1691897 | 0.73 | HSD11B1 (0.40) | CHRM2CHRM1CHRM3HSD11B1NPC1 |
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-9732083-B2 | Tricyclic gyrase inhibitors | MERCK SHARP & DOHME CORP. (US) | 2017-08-15 | — | — | US | disclosed |