Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 13/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | TOP1 | P11387 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | CASP1 | P29466 | 1/20 | 0.56 |
| ▸ | CASP7 | P55210 | 1/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.56 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | TOP2A | P11388 | 1/20 | 0.55 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.55 |
| ▸ | PRSS1 | P07477 | 4/20 | 0.52 |
| ▸ | TMPRSS15 | P98073 | 3/20 | 0.52 |
| ▸ | F2 | P00734 | 2/20 | 0.46 |
| ▸ | F10 | P00742 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9254391 | 0.86 | ST14 (0.54) | PRSS1F2F10 | |
| SCHEMBL9254014 | 0.86 | NQO2 (0.55) | NQO2ALDH1A1TOP1HPGDCASP1 | |
| SCHEMBL9258660 | 0.85 | F2 (0.44) | NQO2ALDH1A1HPGDHSD17B10PRSS1 | |
| SCHEMBL9255174 | 0.84 | NQO2 (0.67) | NQO2ALDH1A1TOP1HPGDCASP1 | |
| SCHEMBL9254388 | 0.83 | F2 (0.43) | NQO2PRSS1TMPRSS15F2F10 | |
| SCHEMBL9253071 | 0.82 | NQO2 (0.56) | NQO2PRSS1TMPRSS15F2F10 | |
| SCHEMBL9253124 | 0.81 | F2 (0.45) | PRSS1TMPRSS15F2F10 | |
| Acetic Acid SCHEMBL3506391 | 0.80 | NQO2 (0.82) | NQO2ALDH1A1TOP1HPGDCASP1 | |
| SCHEMBL9257420 | 0.79 | F2 (0.48) | NQO2PRSS1TMPRSS15F2F10 | |
| SCHEMBL23566020 | 0.79 | NQO2 (0.79) | NQO2ALDH1A1TOP1HPGDCASP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5463071-A | Tetrazole derivatives; useful for inhibiting undesirable cell aggregation | DR. KARL THOMAE GMBH (DE) | 1995-10-31 | — | — | US | disclosed |
| EP-0525629-A2 | 5-membered heterocycles, process for their preparation and medicaments containing them | Dr. Karl Thomae GmbH (DE) | 1993-02-03 | — | — | EP | disclosed |