Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | TYK2 | P29597 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8461160 | 0.84 | SMN1; SMN2 (0.47) | CYP2D6SLC6A2SLC6A4SLC6A3LMNA | |
| SCHEMBL8460781 | 0.78 | CYP2D6 (0.47) | CYP2D6SLC6A2SLC6A4SLC6A3LMNA | |
| SCHEMBL8458492 | 0.75 | CYP2D6 (0.47) | CYP2D6KMT2ALMNASRC | |
| SCHEMBL8458472 | 0.75 | CYP2D6 (0.47) | CYP2D6SLC6A2SLC6A3KMT2ALMNA | |
| SCHEMBL6803687 | 0.71 | SLC6A2 (0.58) | CYP2D6SLC6A2SLC6A4SLC6A3KMT2A | |
| SCHEMBL8461236 | 0.71 | CYP2D6 (0.42) | CYP2D6LMNASMN1; SMN2KDM4EHSD17B10 | |
| SCHEMBL7824857 | 0.70 | CYP2D6 (1.00) | CYP2D6KMT2ALMNASRC | |
| SCHEMBL7815004 | 0.70 | CYP2D6 (1.00) | CYP2D6KMT2ALMNASRC | |
| SCHEMBL659768 | 0.70 | CYP2D6 (1.00) | CYP2D6KMT2ALMNASRC | |
| SCHEMBL11315838 | 0.70 | CYP2D6 (1.00) | CYP2D6KMT2ALMNASRC |
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 |
|---|---|---|---|---|---|---|---|
| EP-0936914-A1 | HYDROXY-PHOSPHINYL DERIVATIVES USEFUL AS NAALADASE INHIBITORS | GUILFORD PHARMACEUTICALS INC. (US) | 1999-08-25 | — | — | EP | disclosed |
| EP-0936914-A4 | — | — | 1999-08-25 | — | — | EP | disclosed |
| WO-1997048400-A1 | HYDROXY-PHOSPHINYL DERIVATIVES USEFUL AS NAALADASE INHIBITORS | GUILFORD PHARMACEUTICALS INC. (US) | 1997-12-24 | — | — | WO | disclosed |