Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.44 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.43 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.43 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL26025126 | 0.85 | AOC3 (0.54) | AOC3CYP2C19SMN1; SMN2POLBCYP1A2 | |
| SCHEMBL28554357 | 0.84 | ALDH1A1 (0.49) | SMN1; SMN2POLBKDM4ETSHRKMT2A | |
| SCHEMBL393804 | 0.81 | HTR2A (0.57) | AOC3TAAR1 | |
| SCHEMBL27586400 | 0.81 | AOC3 (0.47) | AOC3CYP2C19SMN1; SMN2POLBCYP1A2 | |
| SCHEMBL393805 | 0.81 | HTR2A (0.57) | AOC3TAAR1 | |
| SCHEMBL28150234 | 0.80 | KDM4E (0.49) | AOC3CYP2C19SMN1; SMN2POLBKDM4E | |
| SCHEMBL9053983 | 0.79 | AOC3 (0.41) | AOC3GABRA1GABRB2KDM4EKMT2A | |
| SCHEMBL491064 | 0.79 | LDHA (0.54) | AOC3CYP2C19SMN1; SMN2POLBCYP1A2 | |
| SCHEMBL14721314 | 0.77 | PKM (0.43) | AOC3CYP2C19SMN1; SMN2POLBCYP1A2 | |
| SCHEMBL9117933 | 0.76 | GABRA1 (0.35) | GABRA1GABRB2KDM4EKMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-3587569-B2 | Optically active 1- ( 3,4- trimethoxyphenyl ) -2-propanol method for producing | — | 2004-11-10 | — | — | JP | disclosed |