Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | HTR3A | P46098 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.43 |
| ▸ | HTR3B | O95264 | 2/20 | 0.43 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.43 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.43 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29846830 | 0.88 | HTR4 (0.54) | CYP3A4KCNH2HTR2AHTR4 | |
| SCHEMBL29846578 | 0.82 | BCHE (0.49) | ALDH1A1TSHRHDAC1LMNA | |
| SCHEMBL29846864 | 0.82 | NR3C1 (0.43) | LMNA | |
| SCHEMBL29846664 | 0.80 | KMT2A (0.50) | ALDH1A1KDM4EGAASMN1; SMN2LMNA | |
| SCHEMBL29846797 | 0.80 | HDAC3 (0.41) | HDAC3HDAC1LMNA | |
| SCHEMBL29846496 | 0.78 | LMNA (0.45) | GAALMNAHTR4 | |
| SCHEMBL29846668 | 0.78 | KLKB1 (0.42) | ALDH1A1KDM4ECYP3A4GAASMN1; SMN2 | |
| SCHEMBL29846482 | 0.77 | LMNA (0.51) | SMN1; SMN2LMNA | |
| SCHEMBL29846582 | 0.77 | LMNA (0.53) | ALDH1A1PKMGAASMN1; SMN2LMNA | |
| SCHEMBL29846685 | 0.76 | KDM4E (0.51) | ALDH1A1POLBPKMHTR3AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022123530-A1 | BORONIC ACID COMPOUND | 주식회사 엘지화학 | 2022-06-16 | — | — | WO | disclosed |