Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 6/20 | 0.37 |
| ▸ | MMP1 | P03956 | 5/20 | 0.37 |
| ▸ | MMP3 | P08254 | 5/20 | 0.37 |
| ▸ | MMP7 | P09237 | 5/20 | 0.37 |
| ▸ | MMP9 | P14780 | 5/20 | 0.37 |
| ▸ | MMP13 | P45452 | 5/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MMP14 | P50281 | 1/20 | 0.35 |
| ▸ | TYR | P14679 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL686436 | 0.94 | CYP1A2 (0.42) | ALDH1A1CYP1A2ALOX5SMN1; SMN2TYR | |
| Ethylene SCHEMBL29048893 | 0.89 | CYP1A2 (0.39) | ALDH1A1CYP1A2ALOX5SMN1; SMN2TYR | |
| SCHEMBL29595346 | 0.89 | TYR (0.41) | TYRPTGS2 | |
| Ethylene Glycol SCHEMBL29048889 | 0.84 | CYP1A2 (0.40) | ALDH1A1CYP1A2ALOX5SMN1; SMN2CYP2C19 | |
| SCHEMBL21628043 | 0.82 | TYR (0.46) | MAPK1TYRPTGS2 | |
| SCHEMBL10594958 | 0.81 | PTGS2 (0.53) | ALDH1A1CYP1A2PTGS2CYP2C19 | |
| SCHEMBL11442832 | 0.78 | LMNA (0.40) | MAPK1ALOX5PTGS2 | |
| SCHEMBL874206 | 0.75 | TYR (0.58) | ALDH1A1MAPK1TYRPOLB | |
| SCHEMBL454717 | 0.75 | TYR (0.58) | ALDH1A1MAPK1TYRPOLB | |
| SCHEMBL30620714 | 0.75 | ALDH1A1 (0.48) | ALDH1A1MAPK1CYP1A2ALOX5MMP2 |
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-5136013-A | Polyesters | BAYER AKTIENGESELLSCHAFT (DE) | 1992-08-04 | — | — | US | disclosed |
| US-5068300-A | BIFUNCTIONAL STILBENE COMPOUNDS CONTAINING AT LEAST ONE Z-CONFIGURATED STILBENE GROUP, PROCESS FOR THEIR PREPARATION AND THEIR USE FOR THE PREPARATION OF POLYMERS | BAYER AKTIENGESELLSCHAFT (DE) | 1991-11-26 | — | — | US | disclosed |