Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.49 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | TNF | P01375 | 1/20 | 0.46 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.46 |
| ▸ | XDH | P47989 | 1/20 | 0.45 |
| ▸ | KIF11 | P52732 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | SNCA | P37840 | 1/20 | 0.39 |
| ▸ | JAK2 | O60674 | 1/20 | 0.39 |
| ▸ | JAK1 | P23458 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28357497 | 0.84 | NPC1 (0.38) | RAB9ANPC1KDM4EHSD17B1HSD17B2 | |
| SCHEMBL28357499 | 0.84 | NPC1 (0.38) | RAB9ANPC1KDM4EHSD17B1HSD17B2 | |
| SCHEMBL17752213 | 0.83 | KIF11 (0.44) | RAB9ANPC1KDM4ETNFNOD1 | |
| SCHEMBL18120004 | 0.82 | HSD17B1 (0.54) | RAB9ANPC1KDM4EHSD17B1HSD17B2 | |
| SCHEMBL16378757 | 0.81 | RAB9A (0.50) | RAB9ANPC1KDM4ETNFNOD1 | |
| SCHEMBL30279827 | 0.81 | HSD17B1 (0.49) | HSD17B1HSD17B2CYP3A4CYP2C9XDH | |
| SCHEMBL24721349 | 0.81 | RAB9A (0.46) | RAB9ANPC1KDM4ETNFNOD1 | |
| SCHEMBL17752218 | 0.80 | KIF11 (0.47) | RAB9ANPC1KDM4ETNFNOD1 | |
| SCHEMBL12914315 | 0.79 | TNF (0.43) | RAB9ANPC1KDM4EHSD17B1HSD17B2 | |
| SCHEMBL24721389 | 0.79 | DGAT1 (0.42) | RAB9ANPC1KDM4ETNFNOD1 |
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-109705012-B | Preparation method of 2, 5-diaryl five-membered heterocyclic aromatic hydrocarbon | 西北师范大学 | 2022-04-05 | — | — | CN | disclosed |
| CN-109705012-A | A kind of preparation method of 2,5- diaryl five-ring heterocycles aromatic hydrocarbons | 西北师范大学 | 2019-05-03 | — | — | CN | disclosed |