Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 3/20 | 0.54 |
| ▸ | NR1H3 | Q13133 | 3/20 | 0.54 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.53 |
| ▸ | GSTP1 | P09211 | 2/20 | 0.52 |
| ▸ | PTPN1 | P18031 | 4/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.49 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | PTPRF | P10586 | 1/20 | 0.48 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.48 |
| ▸ | PTPRB | P23467 | 1/20 | 0.48 |
| ▸ | ACP1 | P24666 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL1680623 | 0.85 | CASP3 (0.61) | ENPP2GSTP1PTPN1S1PR5NPSR1 | |
| SCHEMBL31666963 | 0.85 | CASP3 (0.61) | ENPP2GSTP1PTPN1S1PR5NPSR1 | |
| SCHEMBL15437828 | 0.84 | NR1H2 (0.70) | NR1H2NR1H3MEN1ALDH1A1KMT2A | |
| SCHEMBL28080906 | 0.82 | NR1H2 (0.71) | NR1H2NR1H3KDM4EMEN1KMT2A | |
| SCHEMBL30320663 | 0.79 | NR1H2 (0.71) | NR1H2NR1H3NPC1RAB9AKDM4E | |
| SCHEMBL28080839 | 0.78 | NR1H2 (0.68) | NR1H2NR1H3TP53MEN1ALDH1A1 | |
| SCHEMBL15437830 | 0.76 | CASP3 (0.59) | NR1H2NR1H3MEN1ALDH1A1KMT2A | |
| SCHEMBL31667726 | 0.76 | POLB (0.50) | ENPP2GSTP1HRH3MEN1KMT2A | |
| SCHEMBL31667505 | 0.76 | ALDH1A1 (0.52) | ENPP2GSTP1S1PR5MEN1ALDH1A1 | |
| SCHEMBL28831871 | 0.76 | NR1H2 (0.52) | NR1H2NR1H3KDM4EALDH1A1 |
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-103804108-B | A kind of method preparing primary amine | 沈阳药科大学 | 2016-08-03 | — | — | CN | disclosed |