Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.70 |
| ▸ | HTT | P42858 | 2/20 | 0.62 |
| ▸ | POLB | P06746 | 1/20 | 0.60 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | DBH | P09172 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL469648 | 1.00 | PKM (0.70) | PKMHTTPOLBHSD17B1KMT2A | |
| SCHEMBL385574 | 0.84 | PKM (0.75) | PKMHTTPOLBHSD17B1KMT2A | |
| SCHEMBL8845203 | 0.82 | PKM (0.72) | PKMHTTPOLBHSD17B1KMT2A | |
| SCHEMBL9574305 | 0.82 | PKM (1.00) | PKMHTTPOLBHSD17B1KMT2A | |
| SCHEMBL24075452 | 0.81 | PKM (0.50) | PKMHTTPOLBHSD17B1KMT2A | |
| SCHEMBL30426875 | 0.81 | PKM (0.50) | PKMHTTPOLBHSD17B1KMT2A | |
| SCHEMBL10743832 | 0.81 | PKM (0.70) | PKMHTTPOLBHSD17B1KMT2A | |
| SCHEMBL7522545 | 0.80 | CA1 (0.62) | PKMHTTPOLBKMT2AALDH1A1 | |
| SCHEMBL9616832 | 0.79 | PKM (0.68) | PKMHTTPOLBHSD17B1KMT2A | |
| SCHEMBL11125937 | 0.79 | PKM (0.68) | PKMHTTPOLBHSD17B1KMT2A |
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-109761828-A | A kind of preparation method of salbutamol sulfate intermediate | 重庆康刻尔制药有限公司 | 2019-05-17 | — | — | CN | disclosed |