Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | RXRA | P19793 | 1/20 | 0.32 |
| ▸ | RXRB | P28702 | 1/20 | 0.32 |
| ▸ | RXRG | P48443 | 1/20 | 0.32 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.32 |
| ▸ | AOC2 | O75106 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6660490 | 0.78 | TSHR (0.42) | NPC1RAB9ATSHRMEN1KMT2A | |
| SCHEMBL8023262 | 0.78 | TSHR (0.42) | NPC1RAB9ATSHRMEN1KMT2A | |
| SCHEMBL31447203 | 0.78 | TSHR (0.42) | NPC1RAB9ATSHRMEN1KMT2A | |
| SCHEMBL28993193 | 0.77 | HTR7 (0.41) | RAB9ASMN1; SMN2KDM4EMAPTALDH1A1 | |
| SCHEMBL28640739 | 0.76 | MAPT (0.44) | SMN1; SMN2MAPTALDH1A1MAOALMNA | |
| Boric Acid SCHEMBL29046186 | 0.75 | TRPA1 (0.39) | NPC1RAB9AMEN1KMT2AKDM4E | |
| SCHEMBL28993181 | 0.75 | CA4 (0.36) | TSHRMEN1KMT2ACYP1A2MAPT | |
| SCHEMBL13360664 | 0.75 | TSHR (0.39) | NPC1RAB9ATSHRMEN1KMT2A | |
| SCHEMBL2737142 | 0.73 | TSHR (0.45) | NPC1RAB9ATSHRMEN1KMT2A | |
| SCHEMBL29690513 | 0.73 | TSHR (0.45) | NPC1RAB9ATSHRMEN1KMT2A |
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-114874244-A | Preparation method of arylboronic acid ester or alkyl boronate compound | 中国科学院兰州化学物理研究所 | 2022-08-09 | — | — | CN | disclosed |