Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | PTPRA | P18433 | 1/20 | 0.49 |
| ▸ | HRH1 | P35367 | 1/20 | 0.48 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Ethylene Glycol SCHEMBL11532139 | 1.00 | SMN1; SMN2 (0.57) | SMN1; SMN2CYP1A2CYP2C19ALDH1A1FFAR1 | |
| SCHEMBL29499090 | 0.94 | SMN1; SMN2 (0.62) | SMN1; SMN2CYP1A2CYP2C19ALDH1A1FFAR1 | |
| SCHEMBL333243 | 0.94 | SMN1; SMN2 (0.62) | SMN1; SMN2CYP1A2CYP2C19ALDH1A1FFAR1 | |
| 1,4-Butanediol SCHEMBL11531292 | 0.93 | SMN1; SMN2 (0.58) | SMN1; SMN2CYP1A2CYP2C19ALDH1A1FFAR1 | |
| Hydrochloric Acid SCHEMBL4174816 | 0.93 | SMN1; SMN2 (0.60) | SMN1; SMN2CYP1A2CYP2C19ALDH1A1FFAR1 | |
| Hydrochloric Acid SCHEMBL28672925 | 0.93 | SMN1; SMN2 (0.60) | SMN1; SMN2CYP1A2CYP2C19ALDH1A1FFAR1 | |
| Sulfuric Acid SCHEMBL933256 | 0.88 | SMN1; SMN2 (0.55) | SMN1; SMN2CYP1A2CYP2C19ALDH1A1FFAR1 | |
| SCHEMBL3673389 | 0.84 | SMN1; SMN2 (0.73) | SMN1; SMN2CYP1A2CYP2C19ALDH1A1HPGD | |
| SCHEMBL6687222 | 0.84 | SMN1; SMN2 (0.73) | SMN1; SMN2CYP1A2CYP2C19ALDH1A1HPGD | |
| SCHEMBL2302450 | 0.82 | SMN1; SMN2 (0.66) | SMN1; SMN2CYP1A2CYP2C19ALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-4153795-A | Cobalt pyridyl catalysts for hydroformylation | DIRECTOR-GENERAL OF THE AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 1979-05-08 | — | — | US | disclosed |