Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.50 |
| ▸ | CTSD | P07339 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.38 |
| ▸ | ADH1B | P00325 | 1/20 | 0.37 |
| ▸ | ADH1C | P00326 | 1/20 | 0.37 |
| ▸ | ADH1A | P07327 | 1/20 | 0.37 |
| ▸ | ADH7 | P40394 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL243768 | 0.85 | ALDH1A1 (0.56) | ALDH1A1TDP1CTSDTSHRCYP3A4 | |
| SCHEMBL21764766 | 0.79 | ALDH1A1 (0.79) | ALDH1A1TDP1CTSDTSHRCYP3A4 | |
| SCHEMBL13018287 | 0.76 | ALDH1A1 (0.73) | ALDH1A1TDP1CTSDTSHRCYP3A4 | |
| SCHEMBL27814664 | 0.73 | PTPN1 (0.44) | ALDH1A1TDP1CTSDMAPTSMN1; SMN2 | |
| SCHEMBL10797576 | 0.71 | SMN1; SMN2 (0.63) | TSHREPHX1MAPTTP53EPHX2 | |
| SCHEMBL9174022 | 0.70 | ALDH1A1 (0.61) | ALDH1A1TDP1CYP3A4HSD17B10GAA | |
| SCHEMBL11666650 | 0.70 | ALDH1A1 (0.48) | ALDH1A1TDP1CTSDTSHRCYP3A4 | |
| Hydrazobenzene SCHEMBL51179 | 0.69 | ALDH1A1 (1.00) | ALDH1A1TDP1CTSDTSHRCYP3A4 | |
| SCHEMBL19737269 | 0.69 | ALDH1A1 (1.00) | ALDH1A1TDP1CTSDTSHRCYP3A4 | |
| SCHEMBL23353504 | 0.69 | ALDH1A1 (1.00) | ALDH1A1TDP1CTSDTSHRCYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103980223-B | 2-substituent group-5-substituted anilinic-1,3,4-diazoles derivant and synthetic method thereof and application | 贵州大学 | 2016-11-09 | — | — | CN | claimed |
| CN-111808001-A | 2- ((disubstituted sulfuryl) methylene) -N-aryl hydrazine-1-formamide derivative, and preparation method and application thereof | 贵州大学 | 2020-10-23 | — | — | CN | disclosed |
| CN-103980223-B | 2-substituent group-5-substituted anilinic-1,3,4-diazoles derivant and synthetic method thereof and application | 贵州大学 | 2016-11-09 | — | — | CN | disclosed |