Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.47 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.47 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 3/20 | 0.44 |
| ▸ | CA9 | Q16790 | 3/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | HPN | P05981 | 2/20 | 0.44 |
| ▸ | PLAU | P00749 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4859034 | 1.00 | NPSR1 (0.52) | NPSR1ALDH1A1HTTSLC1A3SLC1A2 | |
| SCHEMBL177000 | 1.00 | NPSR1 (0.52) | NPSR1ALDH1A1HTTSLC1A3SLC1A2 | |
| SCHEMBL7092708 | 0.96 | NPSR1 (0.51) | NPSR1ALDH1A1HTTSLC1A3SLC1A2 | |
| SCHEMBL2840439 | 0.96 | NPSR1 (0.51) | NPSR1ALDH1A1HTTSLC1A3SLC1A2 | |
| Hydrochloric Acid SCHEMBL19716224 | 0.96 | NPSR1 (0.51) | NPSR1ALDH1A1HTTSLC1A3SLC1A2 | |
| SCHEMBL2844278 | 0.96 | NPSR1 (0.51) | NPSR1ALDH1A1HTTSLC1A3SLC1A2 | |
| P-Xylene SCHEMBL5424500 | 0.96 | ALDH1A1 (0.52) | NPSR1ALDH1A1HTTSLC1A3SLC1A2 | |
| SCHEMBL28382647 | 0.96 | ALDH1A1 (0.52) | NPSR1ALDH1A1HTTSLC1A3SLC1A2 | |
| SCHEMBL3342411 | 0.96 | ALDH1A1 (0.52) | NPSR1ALDH1A1HTTSLC1A3SLC1A2 | |
| P-Xylene SCHEMBL5421492 | 0.96 | ALDH1A1 (0.52) | NPSR1ALDH1A1HTTSLC1A3SLC1A2 |
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-1174426-A1 | METHOD FOR THE PREPARATION OF TRICYCLIC AMINO ALCOHOL DERIVATIVES THROUGH AZIDES | Asahi Kasei Kabushiki Kaisha (JP) | 2002-01-23 | — | — | EP | disclosed |