Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.54 |
| ▸ | HPGDS | O60760 | 1/20 | 0.54 |
| ▸ | AURKA | O14965 | 1/20 | 0.51 |
| ▸ | ABL1 | P00519 | 1/20 | 0.51 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.51 |
| ▸ | LCK | P06239 | 1/20 | 0.51 |
| ▸ | CSF1R | P07333 | 1/20 | 0.51 |
| ▸ | RET | P07949 | 1/20 | 0.51 |
| ▸ | MET | P08581 | 1/20 | 0.51 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.51 |
| ▸ | PIM1 | P11309 | 1/20 | 0.51 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.51 |
| ▸ | FLT3 | P36888 | 1/20 | 0.51 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.51 |
| ▸ | CDK8 | P49336 | 1/20 | 0.51 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.51 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.51 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.51 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL20653198 | 0.83 | HPGDS (0.56) | HDAC4HDAC1HPGDSHTTALDH1A1 | |
| SCHEMBL11060936 | 0.77 | HTT (0.55) | HDAC4HDAC1HTTGAAALDH1A1 | |
| SCHEMBL14808808 | 0.77 | HTT (0.50) | HDAC4HDAC1PDGFRBPDGFRAHTT | |
| SCHEMBL16601601 | 0.77 | HTT (0.59) | HDAC4HDAC1PDGFRBPDGFRAHTT | |
| SCHEMBL13960956 | 0.77 | HTT (0.50) | HDAC4HDAC1PDGFRBPDGFRAHTT | |
| SCHEMBL22530437 | 0.77 | CYP11B1 (0.55) | HTTCYP11B1CYP11B2ALDH1A1CYP1A2 | |
| SCHEMBL2625721 | 0.76 | HDAC4 (0.49) | HDAC4HDAC1AURKAABL1NTRK1 | |
| SCHEMBL5362592 | 0.75 | FFAR1 (0.68) | HTTALDH1A1PTPN1CYP1A2 | |
| SCHEMBL1924100 | 0.74 | HTT (0.78) | HTTGAAALDH1A1PTPN1CYP1A2 | |
| SCHEMBL22589209 | 0.74 | ALDH1A1 (0.52) | HPGDSABL1HTTCYP11B1CYP11B2 |
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-113712964-B | Application of 9,10 dihydrophenanthrene compound in preparation of coronavirus 3CL protease inhibitor | 上海中医药大学 | 2023-04-07 | — | — | CN | disclosed |
| CN-113712964-A | Application of 9, 10-dihydrophenanthrene compound in preparation of coronavirus 3CL protease inhibitor | 上海中医药大学 | 2021-11-30 | — | — | CN | disclosed |