Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 2/20 | 0.46 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.46 |
| ▸ | PYGL | P06737 | 6/20 | 0.44 |
| ▸ | PYGM | P11217 | 4/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | IDH1 | O75874 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.39 |
| ▸ | AHR | P35869 | 1/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7945047 | 1.00 | BRD4 (0.46) | BRD4CREBBPPYGLPYGMBACE1 | |
| Hydrochloric Acid SCHEMBL30293266 | 0.98 | BRD4 (0.45) | BRD4CREBBPPYGLPYGMBACE1 | |
| SCHEMBL11777530 | 0.85 | BRD4 (0.44) | BRD4CREBBPPYGLPYGMBACE1 | |
| SCHEMBL10361090 | 0.84 | KDM4E (0.53) | BRD4CREBBPHSD17B10MEN1KMT2A | |
| SCHEMBL28978973 | 0.81 | BRD4 (0.38) | BRD4CREBBPPYGLPYGMHSD17B10 | |
| SCHEMBL30960380 | 0.81 | MAPT (0.53) | BRD4CREBBPPYGLPYGMMEN1 | |
| SCHEMBL219216 | 0.81 | MAPT (0.53) | BRD4CREBBPPYGLPYGMMEN1 | |
| SCHEMBL30293234 | 0.80 | PDE3B (0.49) | MEN1KMT2AGAAMAPTMTNR1A | |
| SCHEMBL30293274 | 0.80 | PDE3B (0.49) | MEN1KMT2AGAAMAPTMTNR1A | |
| SCHEMBL29088284 | 0.80 | BRD4 (0.46) | BRD4CREBBPPYGLPYGMGAA |
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-109988093-B | Amine compound for inhibiting SSAO/VAP-1 and application thereof in medicine | 广东东阳光药业有限公司 | 2023-04-07 | — | — | CN | disclosed |