Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| Benzene SCHEMBL7949738 | 0.94 | TP53 (0.43) | TP53TSHRALDH1A1 | |
| Benzene SCHEMBL28519640 | 0.94 | TP53 (0.43) | TP53TSHRALDH1A1 | |
| Benzene SCHEMBL1493040 | 0.94 | TP53 (0.43) | TP53TSHRALDH1A1 | |
| Benzene SCHEMBL28390273 | 0.94 | TP53 (0.43) | TP53TSHRALDH1A1 | |
| Benzene SCHEMBL1444051 | 0.94 | TP53 (0.43) | TP53TSHRALDH1A1 | |
| Benzene SCHEMBL8980183 | 0.88 | TP53 (0.38) | TP53TSHRALDH1A1 | |
| Benzene SCHEMBL1493081 | 0.88 | TP53 (0.38) | TP53TSHRALDH1A1 | |
| Benzene SCHEMBL16111827 | 0.88 | TP53 (0.38) | TP53TSHRALDH1A1 | |
| Benzene SCHEMBL8980187 | 0.88 | TP53 (0.38) | TP53TSHRALDH1A1 | |
| Benzene SCHEMBL9741754 | 0.88 | TP53 (0.38) | TP53TSHRALDH1A1 |
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-108341752-B | Amine compound for inhibiting SSAO/VAP-1 and application thereof in medicine | 广东东阳光药业有限公司 | 2022-12-23 | — | — | CN | disclosed |