Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | LMNA | P02545 | 5/20 | 0.49 |
| ▸ | MEN1 | O00255 | 4/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | TSHR | P16473 | 4/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | CTSS | P25774 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | LTB4R | Q15722 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21848520 | 0.88 | ALDH1A1 (0.51) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| SCHEMBL28329433 | 0.87 | CTSK (0.48) | ALDH1A1MEN1KMT2ANPC1GAA | |
| SCHEMBL28128781 | 0.85 | ALDH1A1 (0.48) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| SCHEMBL28129338 | 0.81 | MEN1 (0.48) | ALDH1A1MEN1KMT2ANPC1GAA | |
| SCHEMBL28128780 | 0.81 | PTPRB (0.45) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| SCHEMBL28900296 | 0.74 | LTB4R (0.43) | ALDH1A1MEN1KMT2AKDM4ELTB4R | |
| SCHEMBL21834844 | 0.73 | FPR1 (0.47) | ALDH1A1LMNAKMT2ATSHRCYP3A4 | |
| SCHEMBL21834843 | 0.73 | FPR1 (0.47) | ALDH1A1LMNAKMT2ATSHRCYP3A4 | |
| SCHEMBL28840049 | 0.72 | ALDH1A1 (0.49) | ALDH1A1LMNAMEN1KMT2ATSHR | |
| SCHEMBL28129296 | 0.71 | GRM2 (0.52) | ALDH1A1LMNAMEN1KMT2ANPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020063399-A1 | METHOD FOR LIGHT-INDUCED DECARBOXYLATION COUPLING OF ACTIVE CARBOXYLIC ACID ESTER UNDER NON-METAL CATALYSIS | 中国科学技术大学 | 2020-04-02 | — | — | WO | disclosed |