Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | LCK | P06239 | 1/20 | 0.41 |
| ▸ | FYN | P06241 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | AHR | P35869 | 1/20 | 0.41 |
| ▸ | NQO1 | P15559 | 5/20 | 0.40 |
| ▸ | KIF11 | P52732 | 1/20 | 0.40 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.37 |
| ▸ | SELP | P16109 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | NPY1R | P25929 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | NPY2R | P49146 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| Pyrrole SCHEMBL27266989 | 0.92 | KIF11 (0.45) | ALDH1A1MAPTCYP1A2LCKFYN | |
| Phenol SCHEMBL28150296 | 0.92 | ALDH1A1 (0.47) | ALDH1A1MAPTCYP1A2LCKFYN | |
| Pyrrole SCHEMBL28097212 | 0.90 | KIF11 (0.44) | ALDH1A1MAPTCYP1A2LCKFYN | |
| Phenol SCHEMBL27690914 | 0.90 | ALDH1A1 (0.46) | ALDH1A1MAPTCYP1A2LCKFYN | |
| Phenol SCHEMBL28784077 | 0.90 | ALDH1A1 (0.46) | ALDH1A1MAPTCYP1A2LCKFYN | |
| Pyrrole SCHEMBL27865761 | 0.90 | KIF11 (0.44) | ALDH1A1MAPTCYP1A2LCKFYN | |
| Pyrrole SCHEMBL28193011 | 0.90 | KIF11 (0.44) | ALDH1A1MAPTCYP1A2LCKFYN | |
| Hydroquinone SCHEMBL27817865 | 0.87 | HPRT1 (0.45) | ALDH1A1MAPTCYP1A2LCKFYN | |
| Piperazine SCHEMBL28106719 | 0.86 | KIF11 (0.41) | ALDH1A1MAPTCYP1A2LCKFYN | |
| Pyridine SCHEMBL27590083 | 0.86 | KIF11 (0.39) | ALDH1A1MAPTCYP1A2LCKFYN |
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-107306965-A | The application of tetrahydrochysene phenylate azoles in disinfectant use in agriculture or microbicide compositions is prepared and preparation method thereof | 江苏耕耘化学有限公司 | 2017-11-03 | — | — | CN | disclosed |