Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.32 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28597803 | 0.89 | XDH (0.43) | XDHGAAKDM4EALDH1A1 | |
| SCHEMBL28606240 | 0.88 | GAA (0.35) | GAABCHEKDM4EALDH1A1POLB | |
| SCHEMBL28918961 | 0.82 | MEN1 (0.35) | GAAKDM4EALDH1A1TDP1 | |
| SCHEMBL28587918 | 0.81 | XDH (0.40) | XDHGAAKDM4EALDH1A1 | |
| SCHEMBL28602072 | 0.81 | SMN1; SMN2 (0.42) | ALDH1A1TDP1L3MBTL1 | |
| SCHEMBL28609039 | 0.81 | XDH (0.64) | XDH | |
| SCHEMBL28592169 | 0.80 | XDH (0.44) | XDHGAA | |
| SCHEMBL28609484 | 0.80 | SMN1; SMN2 (0.46) | ALDH1A1POLBTDP1 | |
| SCHEMBL28597798 | 0.79 | ALDH1A1 (0.42) | ALDH1A1TDP1 | |
| SCHEMBL28592171 | 0.78 | ALDH1A1 (0.41) | GAAALDH1A1TDP1 |
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-113173917-B | 1-alkyl-5-tetrazolyl/pyrimidone-1H-indole-3-carbonitrile compound and preparation method and application thereof | 沈阳药科大学 | 2022-04-08 | — | — | CN | disclosed |
| CN-113173917-A | 1-alkyl-5-tetrazolyl/pyrimidone-1H-indole-3-carbonitrile compound and preparation method and application thereof | 沈阳药科大学 | 2021-07-27 | — | — | CN | disclosed |