Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 4/20 | 0.88 |
| ▸ | CYP1B1 | Q16678 | 4/20 | 0.88 |
| ▸ | FLT3 | P36888 | 2/20 | 0.80 |
| ▸ | AURKA | O14965 | 1/20 | 0.80 |
| ▸ | KDR | P35968 | 1/20 | 0.80 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.80 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.72 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.72 |
| ▸ | KDM1A | O60341 | 1/20 | 0.72 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.72 |
| ▸ | XDH | P47989 | 1/20 | 0.72 |
| ▸ | IPMK | Q8NFU5 | 1/20 | 0.72 |
| ▸ | IP6K2 | Q9UHH9 | 1/20 | 0.72 |
| ▸ | MEN1 | O00255 | 4/20 | 0.69 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.69 |
| ▸ | TP53 | P04637 | 1/20 | 0.69 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.69 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.69 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.69 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.69 |
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 | |
|---|---|---|---|---|
| SCHEMBL30082755 | 0.94 | CYP1A1 (1.00) | CYP1A1CYP1B1FLT3AURKAKDR | |
| SCHEMBL1764630 | 0.94 | CYP1A1 (1.00) | CYP1A1CYP1B1FLT3AURKAKDR | |
| SCHEMBL30375958 | 0.93 | HDAC6 (0.84) | CYP1A1CYP1B1FLT3AURKAKDR | |
| SCHEMBL7606758 | 0.93 | HDAC6 (0.84) | CYP1A1CYP1B1FLT3AURKAKDR | |
| SCHEMBL8069022 | 0.91 | FLT3 (0.86) | CYP1A1CYP1B1FLT3AURKAKDR | |
| SCHEMBL30799172 | 0.91 | FLT3 (0.86) | CYP1A1CYP1B1FLT3AURKAKDR | |
| SCHEMBL8064387 | 0.90 | KDM4E (0.83) | CYP1A1CYP1B1MEN1KMT2AHSD17B2 | |
| Eupatorin SCHEMBL29386042 | 0.89 | CYP1A1 (1.00) | CYP1A1CYP1B1FLT3AURKAKDR | |
| Eupatorin SCHEMBL30334912 | 0.89 | CYP1A1 (1.00) | CYP1A1CYP1B1FLT3AURKAKDR | |
| Eupatorin SCHEMBL555597 | 0.89 | CYP1A1 (1.00) | CYP1A1CYP1B1FLT3AURKAKDR |
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 |
|---|---|---|---|---|---|---|---|
| US-6025387-A | Gastroprotective flavone/flavanone compounds with therapeutic effect on inflammatory bowel disease | DONG A PHARMACEUTICAL CO., LTD. (KR) | 2000-02-15 | — | — | US | disclosed |