Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | SCN1A | P35498 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL422200 | 0.81 | SIGMAR1 (0.56) | SIGMAR1POLBL3MBTL3HRH3KMT2A | |
| SCHEMBL5395459 | 0.79 | SIGMAR1 (0.53) | SIGMAR1POLBL3MBTL3KMT2AMEN1 | |
| SCHEMBL3186832 | 0.73 | SIGMAR1 (0.55) | SIGMAR1POLBL3MBTL3HRH3CYP1A2 | |
| SCHEMBL3176117 | 0.73 | SIGMAR1 (0.63) | SIGMAR1POLBL3MBTL3ALDH1A1CYP1A2 | |
| SCHEMBL9539677 | 0.73 | SIGMAR1 (0.79) | SIGMAR1POLBKMT2AMEN1HTT | |
| SCHEMBL78043 | 0.73 | SIGMAR1 (0.79) | SIGMAR1POLBKMT2AMEN1HTT | |
| SCHEMBL3135711 | 0.72 | HRH3 (0.54) | SIGMAR1POLBL3MBTL3HRH3KMT2A | |
| SCHEMBL998374 | 0.71 | SIGMAR1 (0.70) | SIGMAR1POLBL3MBTL3HRH3KMT2A | |
| SCHEMBL23235098 | 0.70 | SIGMAR1 (0.60) | SIGMAR1POLBL3MBTL3HRH3KMT2A | |
| SCHEMBL24022514 | 0.70 | SIGMAR1 (0.60) | SIGMAR1POLBL3MBTL3HRH3KMT2A |
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-2021141165-A1 | AMINO ALCOHOL-BORON-BINOL COMPOSITE AND METHOD FOR PREPARING OPTICALLY ACTIVE AMINO ALCOHOL DERIVATIVE USING SAME | (주)분자와물질 | 2021-07-15 | — | — | WO | disclosed |