Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.54 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.51 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | GLA | P06280 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | THPO | P40225 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | APEX1 | P27695 | 1/20 | 0.50 |
| ▸ | BLM | P54132 | 1/20 | 0.50 |
| ▸ | ITGB2 | P05107 | 2/20 | 0.49 |
| ▸ | ICAM1 | P05362 | 2/20 | 0.49 |
| ▸ | ITGAL | P20701 | 2/20 | 0.49 |
| ▸ | REN | P00797 | 1/20 | 0.48 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL31326521 | 1.00 | CYP3A4 (0.54) | CYP3A4SLC7A5ALDH1A1HRH4HRH3 | |
| SCHEMBL12711228 | 0.90 | REN (0.54) | CYP3A4SLC7A5ALDH1A1HRH4HRH3 | |
| SCHEMBL15119370 | 0.89 | CYP3A4 (0.51) | CYP3A4SLC7A5ALDH1A1HRH4HRH3 | |
| SCHEMBL13979576 | 0.89 | CYP3A4 (0.51) | CYP3A4SLC7A5ALDH1A1HRH4HRH3 | |
| SCHEMBL1641647 | 0.89 | CYP3A4 (0.51) | CYP3A4SLC7A5ALDH1A1HRH4HRH3 | |
| SCHEMBL163397 | 0.86 | ITGB2 (0.60) | CYP3A4SLC7A5ALDH1A1HRH4HRH3 | |
| SCHEMBL27043238 | 0.86 | ITGB2 (0.60) | CYP3A4SLC7A5ALDH1A1HRH4HRH3 | |
| SCHEMBL151336 | 0.86 | ITGB2 (0.60) | CYP3A4SLC7A5ALDH1A1HRH4HRH3 | |
| Hydrochloric Acid SCHEMBL11744091 | 0.84 | ITGB2 (0.59) | CYP3A4SLC7A5ALDH1A1HRH4HRH3 | |
| SCHEMBL16558589 | 0.84 | CYP3A4 (0.50) | CYP3A4SLC7A5ALDH1A1HRH4HRH3 |
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-20070141630-A1 | IDENTIFICATION OF NON-COVALENT COMPLEXES BY MASS SPECTROMETRY | GENENTECH, INC. (US) | 2007-06-21 | — | — | US | disclosed |