Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 5/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10894837 | 0.80 | ALDH1A1 (0.43) | ALDH1A1LMNAHPGDHTR2AHTR2C | |
| SCHEMBL9690184 | 0.79 | FABP3 (0.46) | ALDH1A1LMNAHPGDHTR2AHTR2C | |
| SCHEMBL10477591 | 0.77 | FABP3 (0.45) | ALDH1A1LMNAHTR2AHTR2CHTR2B | |
| SCHEMBL10477595 | 0.77 | FABP3 (0.45) | ALDH1A1LMNAHTR2AHTR2CHTR2B | |
| SCHEMBL10477592 | 0.76 | MEN1 (0.41) | ALDH1A1LMNAHPGDHTR2AHTR2C | |
| SCHEMBL27902789 | 0.75 | EPHX1 (0.51) | LMNAHPGDMEN1KMT2ANPC1 | |
| SCHEMBL29199108 | 0.72 | TSHR (0.61) | ALDH1A1LMNAHPGDFABP5KDM4E | |
| SCHEMBL21607181 | 0.70 | ALDH1A1 (0.42) | ALDH1A1LMNAHPGDHTR2AHTR2C | |
| SCHEMBL27885847 | 0.69 | KMT2A (0.45) | ALDH1A1LMNAHPGDMEN1KMT2A | |
| SCHEMBL9616713 | 0.69 | TSHR (0.46) | ALDH1A1HPGDKDM4EGLAGAA |
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 |
|---|---|---|---|---|---|---|---|
| CN-102850300-A | Preparation method of alpha,beta-epoxy amide compounds | CHINESE ACAD INST CHEMISTRY | 2013-01-02 | — | — | CN | disclosed |