Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.41 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.41 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.38 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.38 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | ACP1 | P24666 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | NQO2 | P16083 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7033688 | 1.00 | CYP2A6 (0.44) | CYP2A6ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL30902268 | 1.00 | CYP2A6 (0.44) | CYP2A6ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL29267925 | 0.90 | ALDH1A1 (0.42) | CYP2A6ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL29434773 | 0.76 | CYP2A6 (0.48) | CYP2A6ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL18459198 | 0.76 | ALDH1A1 (0.44) | CYP2A6ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL29524488 | 0.76 | CYP2A6 (0.48) | CYP2A6ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL3103031 | 0.76 | CYP2A6 (0.48) | CYP2A6ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL556218 | 0.76 | CYP2A6 (0.48) | CYP2A6ALDH1A1MEN1KMT2ARXFP1 | |
| SCHEMBL28770513 | 0.74 | CYP1A2 (0.46) | CYP2A6ALDH1A1HSD17B10HIF1ACYP1B1 | |
| SCHEMBL942452 | 0.73 | GRIN2D (0.55) | CYP2A6ALDH1A1HSD17B10HIF1ACYP1B1 |
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-20240215277-A1 | ORGANIC ELECTROLUMINESCENT DEVICE | MERCK PATENT GMBH (DE) | 2024-06-27 | — | — | US | disclosed |