Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.57 |
| ▸ | GFER | P55789 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | STAT6 | P42226 | 1/20 | 0.55 |
| ▸ | HTR1A | P08908 | 1/20 | 0.54 |
| ▸ | HTR2A | P28223 | 1/20 | 0.54 |
| ▸ | HTR7 | P34969 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL8922984 | 1.00 | CYP1A2 (0.60) | CYP1A2CYP2D6ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL2208304 | 0.92 | CYP1A2 (0.71) | CYP1A2CYP2D6ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL30423175 | 0.92 | CYP1A2 (0.71) | CYP1A2CYP2D6ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL12371907 | 0.92 | CYP1A2 (0.71) | CYP1A2CYP2D6ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL15501213 | 0.92 | CYP1A2 (0.71) | CYP1A2CYP2D6ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL11339285 | 0.92 | CYP1A2 (0.71) | CYP1A2CYP2D6ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL11299646 | 0.92 | CYP1A2 (0.71) | CYP1A2CYP2D6ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL19614388 | 0.92 | CYP1A2 (0.71) | CYP1A2CYP2D6ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL11590344 | 0.92 | CYP1A2 (0.71) | CYP1A2CYP2D6ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL422527 | 0.86 | CYP1A2 (0.75) | CYP1A2CYP2D6ALDH1A1SMN1; SMN2KDM4E |
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-5646098-A | Carbonyl containing compounds and their derivatives as multi-functional fuel and lube additives | EXXON CHEMICAL PATENTS INC (US) | 1997-07-08 | — | — | US | disclosed |
| US-5550241-A | Adducts of cyclic carbonyl monomers and substituted alkens | EXXON RESEARCH AND ENGINEERING COMPANY (US) | 1996-08-27 | — | — | US | disclosed |