Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.59 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28557973 | 0.84 | KMT2A (0.55) | NPC1KMT2AMEN1HSD17B10RAB9A | |
| SCHEMBL5350218 | 0.81 | PTPRC (0.48) | PDE4BKMT2AMEN1HSD17B10GAA | |
| SCHEMBL28552097 | 0.81 | NR1H3 (0.57) | NPC1KMT2AMEN1HSD17B10RAB9A | |
| SCHEMBL14288291 | 0.80 | NPC1 (0.69) | NPC1PDE4BKMT2AMEN1HSD17B10 | |
| SCHEMBL28693655 | 0.79 | ALDH1A1 (0.47) | KMT2AMEN1HSD17B10CYP1A2CYP2C9 | |
| SCHEMBL23969583 | 0.78 | PTPRC (0.47) | PDE4BKMT2AMEN1HSD17B10GAA | |
| SCHEMBL28775923 | 0.78 | ALDH1A1 (0.60) | NPC1KMT2AMEN1RAB9ACYP1A2 | |
| SCHEMBL28548628 | 0.78 | GAA (0.60) | NPC1KMT2AMEN1HSD17B10RAB9A | |
| SCHEMBL23969638 | 0.78 | ALDH1A1 (0.47) | KMT2AMEN1HSD17B10CYP1A2CYP2C9 | |
| SCHEMBL30731584 | 0.78 | ALDH1A1 (0.47) | KMT2AMEN1HSD17B10CYP1A2CYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112746289-B | Synthesis method of alkyl borate compound | 合肥工业大学 | 2021-11-09 | — | — | CN | disclosed |
| CN-112746289-A | Synthesis method of alkyl borate compound | 合肥工业大学 | 2021-05-04 | — | — | CN | disclosed |