Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.66 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.59 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.52 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | AHR | P35869 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL21912937 | 0.83 | HTR2A (0.65) | HTR2AGPR84KEAP1NFE2L2KMT2A | |
| SCHEMBL6943161 | 0.82 | HTR2A (0.63) | HTR2AGPR84KEAP1NFE2L2KMT2A | |
| SCHEMBL32679648 | 0.82 | HTR2A (0.63) | HTR2AGPR84KEAP1NFE2L2KMT2A | |
| SCHEMBL6939255 | 0.82 | HTR2A (0.63) | HTR2AGPR84KEAP1NFE2L2KMT2A | |
| SCHEMBL332959 | 0.80 | HTR2A (1.00) | HTR2AGPR84KEAP1NFE2L2KDM4E | |
| SCHEMBL7004405 | 0.79 | HTR2A (0.73) | HTR2AGPR84KEAP1NFE2L2KMT2A | |
| SCHEMBL9889542 | 0.78 | HTR2A (0.71) | HTR2AGPR84KEAP1NFE2L2KMT2A | |
| Water SCHEMBL27796071 | 0.77 | HTR2A (0.93) | HTR2AGPR84KEAP1NFE2L2KDM4E | |
| SCHEMBL28930586 | 0.76 | HTR2A (0.59) | HTR2AGPR84KEAP1NFE2L2KMT2A | |
| SCHEMBL15453266 | 0.76 | HTR2A (0.59) | HTR2AGPR84KEAP1NFE2L2KMT2A |
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-113880871-B | Preparation method of saturated monoboron compound | 中国科学院兰州化学物理研究所 | 2022-08-23 | — | — | CN | disclosed |
| CN-113880871-A | Preparation method of saturated monoboron compound | 中国科学院兰州化学物理研究所 | 2022-01-04 | — | — | CN | disclosed |