Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 6/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11096087 | 0.87 | HPGD (0.47) | HPGDKMT2AHSD17B10CYP1A2CYP3A4 | |
| SCHEMBL11097216 | 0.82 | KMT2A (0.58) | HPGDKMT2AHSD17B10GAAALDH1A1 | |
| SCHEMBL11440098 | 0.80 | POLB (0.42) | HPGDKMT2AHSD17B10GAAALDH1A1 | |
| SCHEMBL11091273 | 0.79 | ALDH1A1 (0.59) | HPGDKMT2ACYP1A2CYP3A4CYP2C19 | |
| SCHEMBL11433183 | 0.79 | KMT2A (0.67) | HPGDKMT2AGAALMNA | |
| SCHEMBL11095421 | 0.78 | HPGD (0.46) | HPGDKMT2AHSD17B10CYP1A2CYP3A4 | |
| SCHEMBL13622072 | 0.77 | GAA (0.58) | HPGDKMT2AHSD17B10GAAALDH1A1 | |
| SCHEMBL11084593 | 0.76 | SLC6A2 (0.54) | HPGDKMT2AGAALMNAPOLB | |
| SCHEMBL5960318 | 0.74 | ALDH1A1 (0.44) | HPGDKMT2ACYP1A2GAAALDH1A1 | |
| SCHEMBL11093857 | 0.74 | LMNA (0.65) | HPGDKMT2AHSD17B10CYP3A4CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0018100-B1 | SUBSTITUTED AROMATIC BIOLOGICALLY ACTIVE COMPOUND, A PROCESS FOR ITS PREPARATION AND ITS USE AS BIOCIDE | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1984-01-18 | — | — | EP | disclosed |
| EP-0018100-A2 | Substituted aromatic biologically active compound, a process for its preparation and its use as biocide | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1980-10-29 | — | — | EP | disclosed |