Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C2 | P08235 | 5/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | FABP6 | P51161 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.35 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.35 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28030845 | 0.85 | NR3C2 (0.40) | NR3C2NOTUMFABP6CYP1A2KDM4E | |
| Ammonia Solution, Strong SCHEMBL6506701 | 0.78 | NOTUM (0.41) | NR3C2NOTUMKDM4EALDH1A1GAA | |
| SCHEMBL2812418 | 0.78 | BLM (0.41) | CYP1A2L3MBTL1PARP1PARP10MAPT | |
| SCHEMBL13156965 | 0.78 | MAPT (0.44) | CYP1A2KDM4EALDH1A1GAAMAPK14 | |
| SCHEMBL12431219 | 0.78 | AHR (0.41) | NOTUMCYP1A2KDM4EMAPK14PARP1 | |
| SCHEMBL18983714 | 0.78 | DRD2 (0.46) | ALDH1A1MAPTMAOAMAOB | |
| Hydrochloric Acid SCHEMBL10839310 | 0.76 | NOTUM (0.40) | NR3C2NOTUMKDM4EALDH1A1GAA | |
| SCHEMBL10966821 | 0.75 | FABP6 (0.47) | NR3C2NOTUMFABP6CYP1A2KDM4E | |
| SCHEMBL18998227 | 0.75 | CYP1A2 (0.33) | CYP1A2 | |
| SCHEMBL30450885 | 0.74 | CYP1A2 (0.54) | CYP1A2ALDH1A1MAPTMAOAMAOB |
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-104829576-A | Preparation method of 7-fluoropyran derivatives | Hunan huateng pharmaceutical co ltd | 2015-08-12 | — | — | CN | disclosed |