Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 13/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | PBK | Q96KB5 | 1/20 | 0.32 |
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 SCHEMBL5406241 | 0.99 | ACHE (0.38) | ACHEALDH1A1CYP3A4TSHRHSD17B10 | |
| Hydrochloric Acid SCHEMBL5414135 | 0.85 | ACHE (0.33) | ACHEALDH1A1 | |
| Hydrochloric Acid SCHEMBL5403999 | 0.83 | ACHE (0.38) | ACHEALDH1A1CYP3A4TSHRHSD17B10 | |
| SCHEMBL5273960 | 0.83 | ACHE (0.57) | ACHE | |
| Hydrochloric Acid SCHEMBL5404005 | 0.82 | ACHE (0.56) | ACHE | |
| Hydrochloric Acid SCHEMBL5414827 | 0.81 | ACHE (0.54) | ACHE | |
| SCHEMBL6265104 | 0.79 | ACHE (0.58) | ACHEALDH1A1CYP3A4TSHRHSD17B10 | |
| SCHEMBL5277348 | 0.72 | IDO1 (0.45) | ACHEALDH1A1 | |
| Hydrochloric Acid SCHEMBL5406243 | 0.71 | IDO1 (0.44) | ACHEALDH1A1 | |
| Hydrochloric Acid SCHEMBL5413263 | 0.70 | ALDH1A1 (0.34) | ACHEALDH1A1CYP3A4HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1587793-B1 | ENZYME SUBSTRATES, CULTURE MEDIA CONTAINING SAME AND USE THEREOF IN ORDER TO DETECT AMINOPEPTIDASE ACTIVITY AND/OR DIFFERENTIATE GRAM-POSITIVE BACTERIA FROM GRAM-NEGATIVE BACTERIA | BIOMERIEUX SA (FR) | 2007-11-28 | — | — | EP | disclosed |