Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | BRAF | P15056 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | GBA1 | P04062 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.31 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.31 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.31 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29045186 | 0.90 | NPC1 (0.38) | NPC1RAB9AKMT2AKDM4EALDH1A1 | |
| SCHEMBL25475157 | 0.83 | NPC1 (0.40) | NPC1RAB9AKMT2AKDM4EALDH1A1 | |
| SCHEMBL10815933 | 0.83 | KMT2A (0.41) | NPC1RAB9AKMT2AKDM4EALDH1A1 | |
| SCHEMBL20267553 | 0.83 | ALDH1A1 (0.44) | NPC1RAB9AKMT2AKDM4EALDH1A1 | |
| SCHEMBL28419847 | 0.81 | TSHR (0.46) | NPC1RAB9AKMT2AKDM4EALDH1A1 | |
| SCHEMBL25379081 | 0.81 | NPC1 (0.39) | NPC1RAB9AKMT2AKDM4EALDH1A1 | |
| SCHEMBL22372121 | 0.80 | PHLPP2 (0.46) | NPC1RAB9AKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL2421526 | 0.80 | LMNA (0.54) | NPC1RAB9AALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL28891107 | 0.79 | NPC1 (0.40) | NPC1RAB9AKMT2AKDM4EALDH1A1 | |
| SCHEMBL564394 | 0.79 | NPC1 (0.38) | NPC1RAB9AKMT2AALDH1A1LMNA |
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-111187218-B | Application of 1-substituted-1H-imidazole-2-carboxylic acid compound in preparation of metal beta-lactamase inhibitor | 四川大学 | 2023-08-04 | — | — | CN | disclosed |
| CN-111253317-B | 1-substituted-1H-imidazole-2-carboxylic acid compound | 四川大学 | 2023-08-04 | — | — | CN | disclosed |