Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB4 | P30926 | 4/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 4/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | GMNN | O75496 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | BLM | P54132 | 2/20 | 0.34 |
| ▸ | PMP22 | Q01453 | 2/20 | 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 | |
|---|---|---|---|---|
| Tetrylammonium SCHEMBL8573162 | 0.89 | ALDH1A1 (0.36) | CHRNB4CHRNA3CHRNA7ALDH1A1CYP2A6 | |
| Tetramethylammonium Ion SCHEMBL8566188 | 0.85 | ALDH1A1 (0.40) | ALDH1A1CYP2A6CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL8077901 | 0.85 | ALDH1A1 (0.43) | ALDH1A1CYP2A6CYP1A2CYP2C9CYP2C19 | |
| Tetrabuthylammonium SCHEMBL8571197 | 0.84 | SLC22A1 (0.36) | ALDH1A1CYP1A2CYP2C9CYP2C19TDP1 | |
| Tetrylammonium SCHEMBL381518 | 0.79 | CHRNA7 (0.42) | CHRNB4CHRNA3CHRNA7ALDH1A1CYP1A2 | |
| Tetrylammonium SCHEMBL18041361 | 0.77 | HTR1B (0.36) | CHRNB4CHRNA3CHRNA7ALDH1A1CYP2A6 | |
| Tetrabuthylammonium SCHEMBL8571427 | 0.74 | CNR2 (0.35) | ALDH1A1CYP2A6CYP2C9TDP1KDM4E | |
| SCHEMBL8571147 | 0.74 | CYP2A6 (0.45) | ALDH1A1CYP2A6CYP1A2TDP1MEN1 | |
| Tetramethylammonium Ion SCHEMBL8571556 | 0.74 | CYP2A6 (0.41) | ALDH1A1CYP2A6CYP1A2TDP1KDM4E | |
| SCHEMBL17763376 | 0.72 | HTR2A (0.41) | CHRNB4CHRNA3CHRNA7ALDH1A1CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| US-5814427-A | RESIN BINDER, FOR REUSE OF WASTE PAPER | BANDO CHEMICAL INDUSTRIES, LTD. (JP) | 1998-09-29 | — | — | US | disclosed |
| EP-0678790-A1 | DECOLORABLE TONER AND PRODUCTION METHOD THEREFOR | BANDO CHEMICAL INDUSTRIES, LTD. (JP) | 1995-10-25 | — | — | EP | disclosed |