Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | ADH1C | P00326 | 2/20 | 0.31 |
| ▸ | ADH1A | P07327 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL245842 | 0.83 | — | — | |
| Ammonia Solution, Strong SCHEMBL8083392 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL29280861 | 0.80 | — | — | |
| Formic Acid Methyl Ester SCHEMBL28826696 | 0.77 | PDE4A (0.31) | — | |
| SCHEMBL19346831 | 0.77 | ADH1A (0.35) | ACHEADH1CADH1A | |
| SCHEMBL4745532 | 0.77 | DPP4 (0.36) | DPP4DPP7 | |
| SCHEMBL20532 | 0.76 | — | — | |
| Cyclobutanol SCHEMBL27786782 | 0.76 | — | — | |
| Formic Acid Methyl Ester SCHEMBL27916766 | 0.76 | — | — | |
| Cyclobutane Carbaldehyde SCHEMBL29132323 | 0.74 | ADH1C (0.31) | ADH1CADH1A |
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 |
|---|---|---|---|---|---|---|---|
| CN-104583197-B | New bicyclicpyridine derivatives | 霍夫曼-拉罗奇有限公司 | 2017-05-17 | — | — | CN | disclosed |