Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.34 |
| ▸ | CA6 | P23280 | 1/20 | 0.34 |
| ▸ | CA5A | P35218 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.34 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.34 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.34 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.34 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.34 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.34 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28532508 | 0.77 | THRB (0.42) | ALDH1A1CYP3A4TSHRCYP2C19SMN1; SMN2 | |
| SCHEMBL4508305 | 0.77 | ELANE (0.42) | ALDH1A1GAATSHRSMN1; SMN2CA4 | |
| SCHEMBL56273 | 0.74 | ORAI1 (0.42) | CYP3A4TSHRCYP2C19SMN1; SMN2PKM | |
| SCHEMBL1672441 | 0.73 | ORAI1 (0.46) | ALDH1A1TSHRCA4CA6CA5A | |
| SCHEMBL28664851 | 0.71 | TRPV6 (0.44) | ALDH1A1TSHRCA4CA6CA5A | |
| SCHEMBL2143307 | 0.71 | CYP3A4 (0.40) | ALDH1A1CYP3A4TSHRSMN1; SMN2PKM | |
| SCHEMBL163578 | 0.71 | ALDH1A1 (0.50) | ALDH1A1GAAHTTCYP3A4SMN1; SMN2 | |
| Phenylboronic Acid SCHEMBL28892104 | 0.70 | CA4 (0.50) | ALDH1A1HTTTSHRCYP2C19CA4 | |
| SCHEMBL20916961 | 0.70 | LMNA (0.54) | ALDH1A1GAATSHRSMN1; SMN2CA4 | |
| SCHEMBL651370 | 0.70 | ORAI1 (0.42) | ALDH1A1GAACYP3A4TSHRCA4 |
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-114262340-A | Preparation method of aminophenylboronic acid | 蚌埠中实化学技术有限公司 | 2022-04-01 | — | — | CN | disclosed |
| CN-114262340-A | Preparation method of aminophenylboronic acid | 蚌埠中实化学技术有限公司 | 2022-04-01 | — | — | CN | disclosed |