Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.51 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.37 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.37 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29729997 | 1.00 | KCNH2 (0.51) | KCNH2TAAR1HTTALDH1A1HPGD | |
| SCHEMBL27040544 | 1.00 | KCNH2 (0.51) | KCNH2TAAR1HTTALDH1A1HPGD | |
| SCHEMBL27040537 | 1.00 | KCNH2 (0.51) | KCNH2TAAR1HTTALDH1A1HPGD | |
| SCHEMBL30064507 | 1.00 | KCNH2 (0.51) | KCNH2TAAR1HTTALDH1A1HPGD | |
| SCHEMBL30678272 | 0.87 | KCNH2 (0.44) | KCNH2PARP14PARP10SCN3A | |
| SCHEMBL27169398 | 0.87 | KCNH2 (0.44) | KCNH2PARP14PARP10SCN3A | |
| SCHEMBL27169394 | 0.87 | KCNH2 (0.44) | KCNH2PARP14PARP10SCN3A | |
| SCHEMBL30678302 | 0.84 | TEAD1 (0.52) | KCNH2KMT2ALTA4H | |
| SCHEMBL29641401 | 0.83 | HTR2C (0.53) | MEN1GAAKMT2AKDM4ENPC1 | |
| SCHEMBL22232708 | 0.83 | HTR2C (0.53) | MEN1GAAKMT2AKDM4ENPC1 |
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-117255792-A | Heteroaryl derivatives, process for preparing the same and pharmaceutical compositions comprising the same as active ingredient | 沃若诺伊公司 | 2023-12-19 | — | — | CN | disclosed |