Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 7/20 | 0.44 |
| ▸ | CNR2 | P34972 | 6/20 | 0.43 |
| ▸ | CNR1 | P21554 | 5/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA4 | P22748 | 2/20 | 0.42 |
| ▸ | CA6 | P23280 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28848580 | 0.92 | HTR1A (0.39) | HTR2ACA1CA2CA4CA6 | |
| SCHEMBL26684865 | 0.84 | HTR2A (0.43) | HTR2ACNR2CNR1KDM4EALDH1A1 | |
| SCHEMBL26684636 | 0.84 | CNR2 (0.45) | HTR2ACNR2CNR1CA1CA2 | |
| SCHEMBL26684590 | 0.82 | CNR2 (0.46) | HTR2ACNR2CNR1CA1CA2 | |
| SCHEMBL26684938 | 0.82 | CNR2 (0.43) | HTR2ACNR2CNR1KDM4EALDH1A1 | |
| SCHEMBL30668194 | 0.77 | PGK1 (0.42) | HTR2ACNR2CNR1CA1CA2 | |
| SCHEMBL22946219 | 0.77 | PTGS2 (0.55) | HTR2ACNR2CNR1CA2KDM4E | |
| SCHEMBL19943971 | 0.77 | ABCB1 (0.45) | CNR2CNR1KDM4EABCB1 | |
| SCHEMBL5358992 | 0.77 | ABCB1 (0.45) | HTR2ACNR2CNR1ABCB1 | |
| SCHEMBL30668190 | 0.76 | CNR2 (0.41) | HTR2ACNR2CNR1KDM4EALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114957171-B | Novel five-membered heterocycle substituted styrene derivative and preparation method and application thereof | 广东工业大学 | 2024-07-30 | — | — | CN | claimed |
| CN-114957171-A | Novel five-membered heterocyclic substituted styrene derivative and preparation method and application thereof | 广东工业大学 | 2022-08-30 | — | — | CN | claimed |
| CN-114957171-B | Novel five-membered heterocycle substituted styrene derivative and preparation method and application thereof | 广东工业大学 | 2024-07-30 | — | — | CN | disclosed |
| CN-114957171-A | Novel five-membered heterocyclic substituted styrene derivative and preparation method and application thereof | 广东工业大学 | 2022-08-30 | — | — | CN | disclosed |