Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA7 | P43166 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28064268 | 1.00 | KMT2A (0.40) | KMT2AMEN1CYP1A2CYP3A4LMNA | |
| SCHEMBL9988674 | 0.80 | TYR (0.47) | KMT2AMEN1CYP1A2CYP3A4LMNA | |
| SCHEMBL7458752 | 0.80 | TYR (0.47) | KMT2AMEN1CYP1A2CYP3A4LMNA | |
| SCHEMBL11233818 | 0.77 | CES2 (0.46) | KMT2AMEN1CYP1A2CYP3A4LMNA | |
| SCHEMBL5466925 | 0.77 | ESR1 (0.55) | KMT2AMEN1CYP1A2CYP3A4LMNA | |
| SCHEMBL11233821 | 0.77 | CES2 (0.46) | KMT2AMEN1CYP1A2CYP3A4LMNA | |
| SCHEMBL11841217 | 0.77 | CRHBP (0.44) | CYP1A2LMNAMAPK1TSHRPTGS2 | |
| SCHEMBL1641880 | 0.75 | KMT2A (0.42) | KMT2AMEN1CYP1A2CYP3A4LMNA | |
| SCHEMBL26912174 | 0.75 | KMT2A (0.42) | KMT2AMEN1CYP1A2CYP3A4LMNA | |
| SCHEMBL10634489 | 0.74 | ESR1 (0.40) | KMT2AMEN1CYP3A4LMNACA12 |
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-105541597-A | Preparation method of 2,4-dihydroxyphenyl acetic acid | UNIV SUN YAT SEN | 2016-05-04 | — | — | CN | disclosed |