Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.44 |
| ▸ | NOS1 | P29475 | 1/20 | 0.44 |
| ▸ | NOS2 | P35228 | 1/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL28326283 | 0.83 | — | — | |
| SCHEMBL27608977 | 0.80 | CHRM2 (0.42) | NOS3NOS1NOS2CHRM2CHRM4 | |
| SCHEMBL6293625 | 0.79 | — | — | |
| SCHEMBL11254631 | 0.78 | CHRM2 (0.41) | NOS3NOS1NOS2CHRM2CHRM4 | |
| SCHEMBL17318344 | 0.74 | KEAP1 (0.39) | NOS3NOS1NOS2ALDH1A1SMN1; SMN2 | |
| SCHEMBL3166958 | 0.73 | — | — | |
| SCHEMBL1476006 | 0.73 | ALDH1A1 (0.40) | NOS3NOS1NOS2ALDH1A1 | |
| SCHEMBL27958499 | 0.71 | NOS3 (0.49) | NOS3NOS1NOS2ALDH1A1 | |
| SCHEMBL28424185 | 0.70 | SLC6A2 (0.37) | NOS3NOS1NOS2 | |
| SCHEMBL25336760 | 0.69 | CHRM2 (0.44) | CHRM2CHRM4CHRM5CHRM3ALDH1A1 |
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-20060155154-A1 | Process for the selective hydrogenation of alkynes | CATALYTIC DISTILLATION TECHNOLOGIES | 2006-07-13 | — | — | US | disclosed |
| WO-2006073507-A2 | PROCESS FOR THE SELECTIVE HYDROGENATION OF ALKYNES | CATALYTIC DISTILLATION TECHNOLOGIES (US) | 2006-07-13 | — | — | WO | disclosed |