Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.53 |
| ▸ | GRM5 | P41594 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | SOS2 | Q07890 | 1/20 | 0.47 |
| ▸ | TTR | P02766 | 1/20 | 0.46 |
| ▸ | NCF1 | P14598 | 3/20 | 0.45 |
| ▸ | NOS2 | P35228 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.41 |
| ▸ | RELA | Q04206 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL75226 | 0.96 | GRM5 (0.53) | NQO1GRM5KCNH2CYP1A2SOS2 | |
| SCHEMBL27416745 | 0.96 | GRM5 (0.53) | NQO1GRM5KCNH2CYP1A2SOS2 | |
| SCHEMBL29359679 | 0.96 | GRM5 (0.53) | NQO1GRM5KCNH2CYP1A2SOS2 | |
| Methane SCHEMBL27560165 | 0.94 | GRM5 (0.52) | NQO1GRM5KCNH2CYP1A2SOS2 | |
| Hydrochloric Acid SCHEMBL28328423 | 0.94 | GRM5 (0.52) | NQO1GRM5KCNH2CYP1A2SOS2 | |
| Hydrazine SCHEMBL28226443 | 0.92 | GRM5 (0.50) | NQO1GRM5KCNH2CYP1A2SOS2 | |
| Ethylene SCHEMBL4594450 | 0.92 | GRM5 (0.50) | NQO1GRM5KCNH2CYP1A2SOS2 | |
| SCHEMBL15877631 | 0.85 | GRM5 (0.62) | NQO1GRM5KCNH2CYP1A2SOS2 | |
| Pyrrole SCHEMBL28298992 | 0.85 | GRM5 (0.45) | NQO1GRM5KCNH2CYP1A2SOS2 | |
| Quinoline SCHEMBL28130812 | 0.85 | ALDH1A1 (0.61) | NQO1GRM5KCNH2CYP1A2SOS2 |
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-105562049-A | Compound catalyst Fe-N/C-TsOH-600 preparation method | SHAANXI GAOXIN INDUSTRY CO LTD | 2016-05-11 | — | — | CN | disclosed |