Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | HTR2A | P28223 | 2/20 | 0.49 |
| ▸ | HTR2C | P28335 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.49 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL30840071 | 1.00 | MEN1 (0.55) | MEN1KMT2AALDH1A1TSHRKDM4E | |
| Trifluoroacetic Acid SCHEMBL29280925 | 0.94 | MEN1 (0.49) | MEN1KMT2AALDH1A1TSHRKDM4E | |
| SCHEMBL29280878 | 0.85 | KDM4E (0.45) | ALDH1A1TSHRKDM4EHTTSMN1; SMN2 | |
| SCHEMBL29280915 | 0.85 | HTR2A (0.61) | KDM4EHTR2AHTR2CKCNH2HTR1A | |
| SCHEMBL29280877 | 0.83 | KDM4E (0.50) | ALDH1A1TSHRKDM4EHTTSMN1; SMN2 | |
| SCHEMBL29280933 | 0.83 | F10 (0.51) | KMT2AALDH1A1TSHRKDM4EHTT | |
| SCHEMBL30831996 | 0.81 | ALDH1A1 (0.48) | MEN1KMT2AALDH1A1TSHRKDM4E | |
| SCHEMBL29280913 | 0.81 | CACNA1I (0.52) | KMT2AALDH1A1TSHRKDM4EHTT | |
| SCHEMBL29280918 | 0.79 | GABRA5 (0.47) | ALDH1A1TSHRKDM4EHTTSMN1; SMN2 | |
| SCHEMBL1507146 | 0.78 | POLB (0.64) | MEN1KMT2AALDH1A1KDM4EHTT |
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 |