Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.65 |
| ▸ | HPGD | P15428 | 3/20 | 0.65 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.65 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.65 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.65 |
| ▸ | ROR1 | Q01973 | 1/20 | 0.56 |
| ▸ | TP53 | P04637 | 2/20 | 0.51 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.51 |
| ▸ | XDH | P47989 | 2/20 | 0.51 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | CA12 | O43570 | 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 | |
|---|---|---|---|---|
| SCHEMBL28320429 | 0.89 | ROR1 (0.68) | ALDH1A1HPGDHSD17B10CYP3A4ABCG2 | |
| SCHEMBL8064414 | 0.86 | TAS2R31 (0.53) | ALDH1A1HPGDHSD17B10CYP3A4ABCG2 | |
| SCHEMBL5857357 | 0.85 | ALDH1A1 (0.76) | ALDH1A1HPGDHSD17B10CYP3A4ABCG2 | |
| SCHEMBL7064285 | 0.82 | HSD17B10 (0.54) | ALDH1A1HPGDHSD17B10CYP3A4ABCG2 | |
| SCHEMBL18526950 | 0.82 | ROR1 (0.64) | ALDH1A1HPGDHSD17B10CYP3A4ABCG2 | |
| SCHEMBL8063014 | 0.82 | PDE4A (0.54) | ABCG2CYP19A1PDE4D | |
| SCHEMBL8063257 | 0.80 | CYP1A1 (0.73) | ALDH1A1HPGDHSD17B10CYP3A4KDM4E | |
| Dimethylpinocembrin SCHEMBL2879027 | 0.79 | ABCG2 (1.00) | ALDH1A1HPGDHSD17B10CYP3A4ABCG2 | |
| SCHEMBL8052909 | 0.79 | ABCG2 (0.58) | ALDH1A1HPGDHSD17B10CYP3A4ABCG2 | |
| SCHEMBL13091031 | 0.78 | ABCG2 (0.73) | ALDH1A1HSD17B10CYP3A4ABCG2CYP19A1 |
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 |