Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 3/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | IDO1 | P14902 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.48 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28250848 | 0.88 | NPC1 (0.54) | NPC1RAB9AP2RX1KCNK3MAPT | |
| SCHEMBL28250054 | 0.87 | NPC1 (0.56) | CA1GAANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28250055 | 0.84 | F10 (0.54) | CA1ALOX15GAANPC1RAB9A | |
| SCHEMBL28532186 | 0.84 | HDAC1 (0.54) | POLBHDAC1HDAC6GAANPC1 | |
| SCHEMBL28250051 | 0.80 | RAB9A (0.62) | POLBNPSR1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL9134669 | 0.79 | HDAC3 (0.52) | POLBHSD17B10HDAC3CA12CA1 | |
| SCHEMBL5370244 | 0.78 | MAPT (0.45) | POLBHSD17B10HDAC3HDAC1HDAC7 | |
| SCHEMBL10741457 | 0.78 | KCNN4 (0.44) | POLBHSD17B10HDAC3HDAC1HDAC7 | |
| SCHEMBL9987055 | 0.78 | POLB (0.50) | POLBHSD17B10HDAC3CA12CA1 | |
| SCHEMBL28250190 | 0.77 | POLB (0.54) | POLBHSD17B10HDAC3CA12CA1 |
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-108752232-B | Synthetic method of alpha-quaternary carbon amino acid | 四川大学 | 2021-03-19 | — | — | CN | disclosed |
| CN-108752232-A | A kind of synthetic method of α-quaternary carbon amino acid | 四川大学 | 2018-11-06 | — | — | CN | disclosed |