Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 2/20 | 0.56 |
| ▸ | TMPRSS4 | Q9NRS4 | 2/20 | 0.56 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | CA1 | P00915 | 17/20 | 0.51 |
| ▸ | CA2 | P00918 | 17/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CA4 | P22748 | 3/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA6 | P23280 | 1/20 | 0.40 |
| ▸ | CA5A | P35218 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27584202 | 0.85 | CA2 (0.64) | CA1CA2CA4CA12CA6 | |
| SCHEMBL6683308 | 0.81 | CA1 (0.47) | CA1CA2LMNACA4CA12 | |
| SCHEMBL16244411 | 0.79 | LMNA (0.53) | TP53TSHRCA1CA2LMNA | |
| SCHEMBL1936079 | 0.77 | LMNA (0.55) | TP53TSHRCA1CA2LMNA | |
| SCHEMBL8758151 | 0.77 | MET (0.56) | CA1CA2LMNACA4CA12 | |
| SCHEMBL3235233 | 0.77 | NPC1 (0.57) | TP53CYP1A2TSHRCA1CA2 | |
| SCHEMBL15650450 | 0.75 | LMNA (0.53) | CYP1A2CYP2D6LMNA | |
| SCHEMBL16244405 | 0.75 | LMNA (0.53) | CYP1A2CA1CA2LMNA | |
| SCHEMBL5703716 | 0.75 | LMNA (0.53) | TP53TSHRLMNA | |
| SCHEMBL6552773 | 0.75 | LMNA (0.53) | TP53TSHRCA1CA2LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112574089-B | Photo-induced multifunctional crosslinking agent, preparation method and application thereof | 中国科学院上海药物研究所 | 2023-09-05 | — | — | CN | disclosed |
| CN-112574089-A | Photoinduced multifunctional cross-linking agent, and preparation method and application thereof | 中国科学院上海药物研究所 | 2021-03-30 | — | — | CN | disclosed |