Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.42 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.42 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.42 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.42 |
| ▸ | TYR | P14679 | 2/20 | 0.41 |
| ▸ | ERN1 | O75460 | 7/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11869494 | 1.00 | ALDH1A1 (0.52) | ALDH1A1TSHRNPC1PKMRAB9A | |
| SCHEMBL30302136 | 0.89 | ALDH1A1 (0.54) | ALDH1A1TSHRNPC1PKMRAB9A | |
| SCHEMBL5265352 | 0.89 | ALDH1A1 (0.54) | ALDH1A1TSHRNPC1PKMRAB9A | |
| SCHEMBL3360913 | 0.89 | CYP2A6 (0.46) | ALDH1A1TSHRNPC1PKMRAB9A | |
| SCHEMBL21953737 | 0.88 | DAPK3 (0.44) | ALDH1A1TSHRNPC1PKMRAB9A | |
| SCHEMBL4889825 | 0.88 | ERN1 (0.50) | ALDH1A1TSHRTYRERN1MEN1 | |
| SCHEMBL31227833 | 0.88 | TNKS2 (0.47) | ALDH1A1TSHRNPC1PKMRAB9A | |
| SCHEMBL764200 | 0.86 | ALDH1A1 (0.41) | ALDH1A1TSHRNPC1PKMRAB9A | |
| SCHEMBL13350235 | 0.84 | ERN1 (0.52) | ALDH1A1TSHRNPC1PKMRAB9A | |
| SCHEMBL13825831 | 0.83 | ESR2 (0.57) | ALDH1A1TSHRNPC1PKMRAB9A |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115286757-B | Covalent organic framework material based on multi-nitrogen olefin connection and preparation method and application thereof | 中原工学院 | 2023-03-10 | — | — | CN | claimed |
| CN-115286757-A | Covalent organic framework material based on multi-nitrogen olefin connection and preparation method and application thereof | 中原工学院 | 2022-11-04 | — | — | CN | claimed |
| CN-115286757-B | Covalent organic framework material based on multi-nitrogen olefin connection and preparation method and application thereof | 中原工学院 | 2023-03-10 | — | — | CN | disclosed |
| CN-115286757-B | Covalent organic framework material based on multi-nitrogen olefin connection and preparation method and application thereof | 中原工学院 | 2023-03-10 | — | — | CN | disclosed |
| CN-115286757-A | Covalent organic framework material based on multi-nitrogen olefin connection and preparation method and application thereof | 中原工学院 | 2022-11-04 | — | — | CN | disclosed |
| CN-115286757-A | Covalent organic framework material based on multi-nitrogen olefin connection and preparation method and application thereof | 中原工学院 | 2022-11-04 | — | — | CN | disclosed |