Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | HTR1A | P08908 | 1/20 | 0.49 |
| ▸ | HTR2C | P28335 | 1/20 | 0.49 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | PTGER3 | P43115 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL26046395 | 0.88 | KDM4E (0.53) | ABCG2KDM4ENFE2L2SMN1; SMN2CYP1A1 | |
| SCHEMBL26046329 | 0.85 | CA1 (0.46) | ABCG2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL26046331 | 0.85 | PKM (0.49) | ABCG2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL30560976 | 0.83 | ABCG2 (0.71) | ABCG2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL285232 | 0.83 | ABCG2 (0.71) | ABCG2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL285231 | 0.83 | ABCG2 (0.71) | ABCG2KDM4EALDH1A1HPGDHSD17B10 | |
| Hydrochloric Acid SCHEMBL4665597 | 0.81 | ABCG2 (0.69) | ABCG2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL26046481 | 0.81 | ABCG2 (0.42) | ABCG2ALDH1A1HPGDNFE2L2SMN1; SMN2 | |
| SCHEMBL26046298 | 0.81 | KDM4E (0.61) | KDM4EALDH1A1HPGDHSD17B10NFE2L2 | |
| SCHEMBL31501086 | 0.80 | ABCG2 (0.55) | ABCG2KDM4EALDH1A1HPGDHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-11746364-B2 | Enzymatic synthesis of kavalactones and flavokavains | WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) | 2023-09-05 | — | — | US | disclosed |
| US-11739354-B2 | Enzymatic synthesis of kavalactones and flavokavains | WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) | 2023-08-29 | — | — | US | disclosed |