Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.58 |
| ▸ | USP2 | O75604 | 1/20 | 0.58 |
| ▸ | XDH | P47989 | 1/20 | 0.46 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.40 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.39 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL25693085 | 0.83 | KDM4E (0.66) | ALDH1A1KDM4EUSP2XDHLMNA | |
| SCHEMBL14934335 | 0.83 | XDH (0.46) | XDHS1PR1S1PR3S1PR5AR | |
| SCHEMBL15801286 | 0.83 | XDH (0.46) | XDHS1PR1S1PR3S1PR5AR | |
| SCHEMBL13678312 | 0.81 | XDH (0.46) | XDHS1PR1S1PR3S1PR5AR | |
| SCHEMBL28986732 | 0.81 | XDH (0.46) | XDHS1PR1S1PR3S1PR5AR | |
| SCHEMBL23916179 | 0.79 | XDH (0.47) | XDHS1PR1S1PR3S1PR5AR | |
| SCHEMBL15801237 | 0.79 | XDH (0.44) | XDHS1PR1S1PR3S1PR5AR | |
| SCHEMBL402072 | 0.78 | XDH (0.46) | ALDH1A1XDHS1PR1S1PR3S1PR5 | |
| SCHEMBL399131 | 0.78 | XDH (0.46) | ALDH1A1XDHS1PR1S1PR3S1PR5 | |
| SCHEMBL30963147 | 0.77 | KDM4E (0.57) | ALDH1A1KDM4EUSP2XDHS1PR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106674098-B | N- (3- cyano -4- alkoxyl phenyl) pyridine carboxamides and application thereof | 中国医科大学 | 2019-07-02 | — | — | CN | disclosed |
| CN-105294584-A | 1-substituted phenyl-1H-1,2,3-triazole compound as well as preparation method and application thereof | UNIV CHINA MEDICAL | 2016-02-03 | — | — | CN | disclosed |