Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.32 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 2/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11197400 | 1.00 | ALDH1A1 (0.48) | ALDH1A1TSHRHPGDGRIK1GRIK2 | |
| SCHEMBL7038737 | 0.86 | ALDH1A1 (0.39) | ALDH1A1TSHRGRIK1GRIK2LMNA | |
| SCHEMBL7038740 | 0.86 | ALDH1A1 (0.39) | ALDH1A1TSHRGRIK1GRIK2LMNA | |
| SCHEMBL11199451 | 0.85 | TSHR (0.52) | TSHRFAAHTRPV1LMNATDP1 | |
| SCHEMBL11199452 | 0.85 | TSHR (0.52) | TSHRFAAHTRPV1LMNATDP1 | |
| Propionaldehyde SCHEMBL28952475 | 0.84 | ALDH1A1 (0.40) | ALDH1A1TSHRGRIK1GRIK2LMNA | |
| SCHEMBL11197293 | 0.84 | TSHR (0.56) | TSHRFAAHTRPV1LMNATDP1 | |
| SCHEMBL11197276 | 0.84 | TSHR (0.56) | TSHRFAAHTRPV1LMNATDP1 | |
| Butanal SCHEMBL7636134 | 0.82 | ALDH1A1 (0.55) | ALDH1A1TSHRGRIK1GRIK2FAAH | |
| Butanal SCHEMBL7636137 | 0.82 | ALDH1A1 (0.55) | ALDH1A1TSHRGRIK1GRIK2FAAH |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4376094-A | Method of disinfecting and a method for destroying bacteria and fungi using 2-substituted glutaraldehydes | STERLING DRUG INC. (US) | 1983-03-08 | — | — | US | claimed |