Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.74 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.74 |
| ▸ | DPP4 | P27487 | 1/20 | 0.52 |
| ▸ | CPB2 | Q96IY4 | 2/20 | 0.47 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.46 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.46 |
| ▸ | PPM1B | O75688 | 2/20 | 0.46 |
| ▸ | HTR3A | P46098 | 1/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | THPO | P40225 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Histidine SCHEMBL137600 | 0.86 | CYP3A4 (1.00) | CYP3A4SLC7A5CPB2HRH4HRH3 | |
| Histidine SCHEMBL388560 | 0.86 | CYP3A4 (1.00) | CYP3A4SLC7A5CPB2HRH4HRH3 | |
| Histidine SCHEMBL3260 | 0.86 | CYP3A4 (1.00) | CYP3A4SLC7A5CPB2HRH4HRH3 | |
| Histidine SCHEMBL19974306 | 0.86 | CYP3A4 (1.00) | CYP3A4SLC7A5CPB2HRH4HRH3 | |
| Histidine SCHEMBL30852263 | 0.86 | CYP3A4 (1.00) | CYP3A4SLC7A5CPB2HRH4HRH3 | |
| Histidine SCHEMBL28071764 | 0.86 | CYP3A4 (1.00) | CYP3A4SLC7A5CPB2HRH4HRH3 | |
| D-Histidine SCHEMBL288043 | 0.86 | CYP3A4 (1.00) | CYP3A4SLC7A5CPB2HRH4HRH3 | |
| Histidine SCHEMBL25362582 | 0.84 | CYP3A4 (0.97) | CYP3A4SLC7A5CPB2HRH4HRH3 | |
| Histidine SCHEMBL23002334 | 0.84 | CYP3A4 (0.97) | CYP3A4SLC7A5CPB2HRH4HRH3 | |
| Histidine SCHEMBL25267810 | 0.84 | CYP3A4 (0.97) | CYP3A4SLC7A5CPB2HRH4HRH3 |
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-1858538-A2 | MUCIN HYPERSECRETION INHIBITORS BASED ON THE STRUCTURE OF MANS AND METHODS OF USE | Biomarck Pharmaceuticals, Ltd. (US) | 2007-11-28 | — | — | EP | disclosed |
| WO-2006078899-A2 | MUCIN HYPERSECRETION INHIBITORS BASED ON THE STRUCTURE OF MANS AND METHODS OF USE | BIOMARCK PHARMACEUTICALS, LTD. (US) | 2006-07-27 | — | — | WO | disclosed |