Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 2/20 | 0.55 |
| ▸ | ADH1C | P00326 | 2/20 | 0.55 |
| ▸ | ADH1A | P07327 | 2/20 | 0.55 |
| ▸ | ADH4 | P08319 | 2/20 | 0.55 |
| ▸ | ADH7 | P40394 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.44 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.44 |
| ▸ | GAPDH | P04406 | 1/20 | 0.44 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | GMNN | O75496 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | THPO | P40225 | 1/20 | 0.41 |
| ▸ | MTOR | P42345 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL3186207 | 0.77 | ADH1B (0.51) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL13494716 | 0.74 | ADH1B (0.53) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL7753100 | 0.74 | ADH1B (0.63) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL11450788 | 0.74 | ADH1B (0.63) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL7883304 | 0.73 | ADH1B (0.52) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL30583121 | 0.72 | ADH1B (0.96) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL18558683 | 0.72 | ADH1B (0.67) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL11111750 | 0.72 | ADH1B (0.67) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL20835080 | 0.72 | ADH1B (0.67) | ADH1BADH1CADH1AADH4ADH7 | |
| SCHEMBL5003472 | 0.72 | ADH1B (0.96) | ADH1BADH1CADH1AADH4ADH7 |
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-5523495-A | REACTING KETONE OR ALDEHYDE WITH A DIHALOPROPENE IN PRESENCE OF ZINC POWDER, WATER AND ACID YIELDS A HALOALLYLCARBINOL WHICH CAN BE DEHALOGENATED WITH A BASE, NONEXPLOSIVE | SUMITOMO CHEMICAL COMPANY LIMITED (JP) | 1996-06-04 | — | — | US | disclosed |