Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 10/20 | 0.51 |
| ▸ | CA1 | P00915 | 9/20 | 0.51 |
| ▸ | CA2 | P00918 | 9/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | PRKCA | P17252 | 1/20 | 0.50 |
| ▸ | AKT1 | P31749 | 1/20 | 0.50 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 6/20 | 0.49 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL12920544 | 0.94 | TSHR (0.58) | CYP2D6ALDH1A1MAPK1TSHRLMNA | |
| SCHEMBL16126769 | 0.92 | CYP2D6 (0.50) | CYP2D6ALDH1A1MAPK1TSHRLMNA | |
| SCHEMBL8722654 | 0.91 | TSHR (0.64) | CYP2D6ALDH1A1MAPK1TSHRLMNA | |
| SCHEMBL8722653 | 0.91 | TSHR (0.64) | CYP2D6ALDH1A1MAPK1TSHRLMNA | |
| SCHEMBL15514610 | 0.91 | TSHR (0.64) | CYP2D6ALDH1A1MAPK1TSHRLMNA | |
| SCHEMBL23742930 | 0.91 | TSHR (0.64) | CYP2D6ALDH1A1MAPK1TSHRLMNA | |
| SCHEMBL10359936 | 0.91 | TSHR (0.64) | CYP2D6ALDH1A1MAPK1TSHRLMNA | |
| SCHEMBL6859193 | 0.89 | LMNA (0.62) | CYP2D6ALDH1A1MAPK1TSHRLMNA | |
| SCHEMBL6867867 | 0.89 | LMNA (0.62) | CYP2D6ALDH1A1MAPK1TSHRLMNA | |
| SCHEMBL17501958 | 0.89 | LMNA (0.58) | CYP2D6ALDH1A1MAPK1TSHRLMNA |
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-108948106-B | Preparation method of 2-hydroxy gulose receptor derivative, bleomycin disaccharide and precursor thereof | 广州中医药大学(广州中医药研究院) | 2021-08-10 | — | — | CN | disclosed |