Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | PKM | P14618 | 1/20 | 0.55 |
| ▸ | GBA1 | P04062 | 2/20 | 0.51 |
| ▸ | CA1 | P00915 | 3/20 | 0.50 |
| ▸ | CA2 | P00918 | 3/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | MMP1 | P03956 | 1/20 | 0.47 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
| ▸ | MMP9 | P14780 | 1/20 | 0.47 |
| ▸ | MMP8 | P22894 | 1/20 | 0.47 |
| ▸ | MMP13 | P45452 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | IL1RN | P18510 | 1/20 | 0.45 |
| ▸ | ERAP1 | Q9NZ08 | 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 | |
|---|---|---|---|---|
| SCHEMBL574791 | 0.80 | MAPK1 (0.64) | ALDH1A1LMNASMN1; SMN2KEAP1KDM4E | |
| SCHEMBL2595618 | 0.78 | ALDH1A1 (0.55) | ALDH1A1LMNASMN1; SMN2KEAP1KDM4E | |
| SCHEMBL1716129 | 0.78 | MAPK1 (0.71) | ALDH1A1LMNASMN1; SMN2KEAP1KDM4E | |
| SCHEMBL6008583 | 0.77 | ALDH1A1 (0.53) | ALDH1A1LMNASMN1; SMN2KEAP1KDM4E | |
| SCHEMBL6008587 | 0.77 | ALDH1A1 (0.53) | ALDH1A1LMNASMN1; SMN2KEAP1KDM4E | |
| SCHEMBL3239491 | 0.77 | ALDH1A1 (0.61) | ALDH1A1LMNASMN1; SMN2KEAP1KDM4E | |
| SCHEMBL1715771 | 0.77 | ALDH1A1 (0.71) | ALDH1A1LMNASMN1; SMN2KEAP1KDM4E | |
| SCHEMBL8349568 | 0.76 | ALDH1A1 (0.79) | ALDH1A1LMNASMN1; SMN2KEAP1KDM4E | |
| SCHEMBL2372216 | 0.76 | ALDH1A1 (0.51) | ALDH1A1LMNASMN1; SMN2KEAP1KDM4E | |
| Hydrochloric Acid SCHEMBL3406093 | 0.75 | ALDH1A1 (0.59) | ALDH1A1LMNASMN1; SMN2KEAP1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-3209819-A1 | GENETIC ENCODING OF CHEMICAL POST-TRANSLATIONAL MODIFICATION FOR PHAGE-DISPLAYED LIBRARIES | The Governors Of The University Of Alberta (CA) | 2017-08-30 | — | — | EP | disclosed |