Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.30 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | BLM | P54132 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
| ▸ | NAPRT | Q6XQN6 | 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 | |
|---|---|---|---|---|
| SCHEMBL19661719 | 0.82 | LMNA (0.30) | LMNA | |
| SCHEMBL29468995 | 0.79 | NOS3 (0.42) | NOS3NOS1NOS2MEN1LMNA | |
| SCHEMBL1114298 | 0.79 | NOS3 (0.42) | NOS3NOS1NOS2MEN1LMNA | |
| SCHEMBL28402709 | 0.78 | PLCG1 (0.32) | — | |
| SCHEMBL24422669 | 0.74 | CYP3A4 (0.39) | — | |
| SCHEMBL28546786 | 0.72 | TSHR (0.31) | — | |
| SCHEMBL22570988 | 0.72 | NOS3 (0.36) | NOS3NOS1NOS2 | |
| SCHEMBL29592069 | 0.71 | TAAR1 (0.33) | LMNA | |
| SCHEMBL29592082 | 0.71 | ALDH1A1 (0.30) | — | |
| SCHEMBL21003778 | 0.70 | CYP2A6 (0.32) | MAPTNAPRT |
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 |