Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | XDH | P47989 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28587916 | 0.91 | XDH (0.48) | MEN1ALDH1A1KMT2ASMN1; SMN2TDP1 | |
| SCHEMBL28591848 | 0.90 | XDH (0.48) | XDH | |
| SCHEMBL28609476 | 0.90 | XDH (0.48) | MEN1ALDH1A1TSHRKMT2ASMN1; SMN2 | |
| SCHEMBL28604692 | 0.89 | MEN1 (0.55) | MEN1ALDH1A1TSHRKMT2ASMN1; SMN2 | |
| SCHEMBL28591847 | 0.87 | XDH (0.50) | XDH | |
| SCHEMBL28596788 | 0.81 | ALDH1A1 (0.55) | MEN1ALDH1A1KMT2ASMN1; SMN2TDP1 | |
| SCHEMBL28609035 | 0.81 | XDH (0.44) | ALDH1A1XDH | |
| SCHEMBL28596769 | 0.81 | XDH (0.49) | XDH | |
| SCHEMBL28613223 | 0.80 | XDH (0.63) | XDH | |
| SCHEMBL28596767 | 0.79 | XDH (0.64) | XDH |
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 4 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 | claimed |
| 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 | claimed |
| 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 |