Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL274543 | 0.90 | HTT (0.42) | HRH3ALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL20464231 | 0.90 | HTT (0.46) | ALDH1A1CYP1A2CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL21132741 | 0.89 | HTT (0.41) | HRH3ALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL14732595 | 0.86 | HRH3 (0.53) | HRH3ALDH1A1 | |
| SCHEMBL13766098 | 0.86 | MAPT (0.53) | HRH3ALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL94062 | 0.86 | HRH3 (0.59) | HRH3ALDH1A1HDAC8HDAC6 | |
| Boric Acid SCHEMBL28203315 | 0.85 | HTT (0.40) | HRH3ALDH1A1CYP1A2CYP2D6CYP2C19 | |
| Hydrochloric Acid SCHEMBL20586696 | 0.84 | HRH3 (0.57) | HRH3ALDH1A1HDAC8HDAC6 | |
| SCHEMBL14356831 | 0.81 | TSHR (0.46) | ALDH1A1CYP1A2CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL21407969 | 0.81 | MAPT (0.46) | HRH3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7297382-B2 | Ink-jet recording material | AGFA-GEVAERT (BE) | 2007-11-20 | — | — | US | disclosed |
| US-7297382-B2 | Ink-jet recording material | AGFA-GEVAERT (BE) | 2007-11-20 | — | — | US | disclosed |
| EP-1419897-B1 | Ink jet recording material | AGFA GEVAERT (BE) | 2007-06-27 | — | — | EP | disclosed |