Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 10/20 | 0.72 |
| ▸ | HRH4 | Q9H3N8 | 9/20 | 0.72 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.72 |
| ▸ | MEN1 | O00255 | 2/20 | 0.72 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.72 |
| ▸ | GLA | P06280 | 1/20 | 0.72 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.72 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.72 |
| ▸ | THPO | P40225 | 1/20 | 0.72 |
| ▸ | LMNA | P02545 | 2/20 | 0.70 |
| ▸ | APEX1 | P27695 | 2/20 | 0.70 |
| ▸ | BLM | P54132 | 1/20 | 0.70 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.54 |
| ▸ | HRH2 | P25021 | 2/20 | 0.47 |
| ▸ | MIF | P14174 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HRH1 | P35367 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3925179 | 0.84 | — | — | |
| SCHEMBL12328968 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL1369323 | 0.82 | HRH3 (1.00) | HRH3HRH4ALDH1A1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL20295958 | 0.82 | HRH3 (1.00) | HRH3HRH4ALDH1A1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL27914617 | 0.82 | HRH3 (1.00) | HRH3HRH4ALDH1A1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL20295961 | 0.82 | HRH3 (1.00) | HRH3HRH4ALDH1A1MEN1KMT2A | |
| SCHEMBL20099454 | 0.81 | HRH4 (0.57) | HRH3HRH4ALDH1A1MEN1KMT2A | |
| SCHEMBL11471016 | 0.81 | HRH4 (0.61) | HRH3HRH4ALDH1A1MEN1KMT2A | |
| SCHEMBL21579874 | 0.80 | HRH3 (0.66) | HRH3HRH4ALDH1A1MEN1KMT2A | |
| SCHEMBL2736110 | 0.79 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017053982-A1 | TRIPTYCENE DERIVATIVES FOR NUCLEIC ACID JUNCTION STABILIZATION | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2017-03-30 | — | — | WO | disclosed |