Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLCN2 | P51788 | 1/20 | 0.53 |
| ▸ | DPP4 | P27487 | 1/20 | 0.48 |
| ▸ | FABP3 | P05413 | 1/20 | 0.45 |
| ▸ | FABP4 | P15090 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | PRKAB2 | O43741 | 2/20 | 0.41 |
| ▸ | PRKAG1 | P54619 | 2/20 | 0.41 |
| ▸ | PRKAA2 | P54646 | 2/20 | 0.41 |
| ▸ | PRKAA1 | Q13131 | 2/20 | 0.41 |
| ▸ | PRKAG3 | Q9UGI9 | 2/20 | 0.41 |
| ▸ | PRKAG2 | Q9UGJ0 | 2/20 | 0.41 |
| ▸ | PRKAB1 | Q9Y478 | 2/20 | 0.41 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.40 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27703247 | 0.86 | DPP4 (0.50) | CLCN2DPP4FABP3FABP4CYP2A6 | |
| SCHEMBL7684364 | 0.85 | CLCN2 (0.47) | CLCN2CYP2A6ALDH1A1MEN1KMT2A | |
| SCHEMBL5567625 | 0.85 | DPP4 (0.50) | CLCN2DPP4ALDH1A1KDM4EHSD17B10 | |
| SCHEMBL27592619 | 0.83 | DPP4 (0.62) | CLCN2DPP4FABP3FABP4CYP2A6 | |
| SCHEMBL28701648 | 0.83 | CLCN2 (0.44) | CLCN2FABP3FABP4CYP2A6ALDH1A1 | |
| SCHEMBL2370422 | 0.79 | DPP4 (0.43) | CLCN2DPP4FABP3FABP4CYP2A6 | |
| SCHEMBL31212990 | 0.78 | CYP2A6 (0.56) | DPP4FABP3FABP4CYP2A6ALDH1A1 | |
| SCHEMBL2136910 | 0.78 | CYP2A6 (0.56) | DPP4FABP3FABP4CYP2A6ALDH1A1 | |
| SCHEMBL27818395 | 0.78 | NPSR1 (0.41) | CLCN2ALDH1A1KDM4E | |
| SCHEMBL28788982 | 0.78 | FABP4 (0.46) | CLCN2FABP3FABP4ALDH1A1KDM4E |
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-116396215-A | Preparation method for hydrolyzing cyano compound into carboxyl compound | 苏利(宁夏)新材料科技有限公司 | 2023-07-07 | — | — | CN | disclosed |