Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 4/20 | 0.37 |
| ▸ | HTR2C | P28335 | 2/20 | 0.37 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.36 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | HTR1D | P28221 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18330811 | 1.00 | ALDH1A1 (0.42) | ALDH1A1HTTPTPN1HTR2AHTR2C | |
| SCHEMBL9844197 | 0.80 | PTPN1 (0.47) | ALDH1A1HTTPTPN1HTR2CPFKFB3 | |
| SCHEMBL29592044 | 0.80 | PTPN1 (0.47) | ALDH1A1HTTPTPN1HTR2CPFKFB3 | |
| SCHEMBL20912810 | 0.77 | CA2 (0.51) | HTR2AHTR2CHTR2BHTR1AHTR1D | |
| SCHEMBL10667646 | 0.77 | CA2 (0.51) | HTR2AHTR2CHTR2BHTR1AHTR1D | |
| SCHEMBL29611417 | 0.77 | CA2 (0.51) | HTR2AHTR2CHTR2BHTR1AHTR1D | |
| SCHEMBL28969310 | 0.76 | HTT (0.39) | ALDH1A1HTTPTPN1PFKFB3MEN1 | |
| SCHEMBL8950172 | 0.76 | HTR1A (0.59) | ALDH1A1HTTPTPN1HTR2AHTR2C | |
| SCHEMBL23929165 | 0.76 | ALDH1A1 (0.39) | ALDH1A1HTTPTPN1PFKFB3MEN1 | |
| SCHEMBL21954375 | 0.75 | PTPN1 (0.46) | ALDH1A1HTTPTPN1HTR2CMEN1 |
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-115667275-B | Boron-containing compounds and uses thereof | 南京再明医药有限公司 | 2024-02-23 | — | — | CN | disclosed |
| CN-115667275-A | Boron-containing compounds and their use | 先声药业有限公司 | 2023-01-31 | — | — | CN | disclosed |