Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA5 | P31644 | 4/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.41 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.40 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.40 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | F10 | P00742 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30843810 | 0.95 | GABRA5 (0.46) | GABRA5KCNH2CACNA1GCACNA1HCACNA1I | |
| SCHEMBL29280928 | 0.95 | GABRA5 (0.46) | GABRA5KCNH2CACNA1GCACNA1HCACNA1I | |
| Trifluoroacetic Acid SCHEMBL29280867 | 0.88 | GABRA5 (0.48) | GABRA5KCNH2CACNA1GCACNA1HCACNA1I | |
| Trifluoroacetic Acid SCHEMBL29208021 | 0.88 | KMT2A (0.40) | KCNH2CACNA1IALDH1A1POLBGAA | |
| Trifluoroacetic Acid SCHEMBL29280897 | 0.87 | GABRA5 (0.43) | GABRA5KCNH2CACNA1GCACNA1HCACNA1I | |
| Trifluoroacetic Acid SCHEMBL29207962 | 0.86 | HTR2A (0.38) | KCNH2CHRM4KMT2AHTR4HTR2A | |
| Trifluoroacetic Acid SCHEMBL29280901 | 0.83 | CACNA1I (0.48) | KCNH2CACNA1IALDH1A1CHRM4KMT2A | |
| Trifluoroacetic Acid SCHEMBL29280870 | 0.83 | ALDH1A1 (0.51) | ALDH1A1POLBGAACHRM4KMT2A | |
| Trifluoroacetic Acid SCHEMBL29280914 | 0.83 | KDM4E (0.42) | KCNH2CACNA1GCACNA1HCACNA1IALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL29280886 | 0.81 | F10 (0.47) | KCNH2CACNA1GCACNA1HCACNA1IALDH1A1 |
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-117820199-A | Amide compound and application thereof in preparation of Sigma2 and 5HT2A inhibitors | 瀚远医药有限公司 | 2024-04-05 | — | — | CN | disclosed |