Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 1/20 | 0.44 |
| ▸ | HRH4 | Q9H3N8 | 3/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | POLA1 | P09884 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | LDHA | P00338 | 1/20 | 0.38 |
| ▸ | LDHB | P07195 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | IDH1 | O75874 | 5/20 | 0.36 |
| ▸ | IDH2 | P48735 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9315949 | 1.00 | NUDT1 (0.44) | NUDT1HRH4CYP2D6CYP2C19MAPT | |
| SCHEMBL15757061 | 0.93 | HRH4 (0.44) | HRH4CYP2D6CYP2C19MAPTPOLB | |
| SCHEMBL28043946 | 0.93 | HRH4 (0.44) | HRH4CYP2D6CYP2C19MAPTPOLB | |
| SCHEMBL15757365 | 0.93 | HRH4 (0.44) | HRH4CYP2D6CYP2C19MAPTPOLB | |
| SCHEMBL135984 | 0.80 | HRH4 (0.50) | NUDT1HRH4CYP2D6CYP2C19MAPT | |
| SCHEMBL29394574 | 0.80 | HRH4 (0.50) | NUDT1HRH4CYP2D6CYP2C19MAPT | |
| SCHEMBL4899755 | 0.80 | HRH4 (0.50) | NUDT1HRH4CYP2D6CYP2C19MAPT | |
| SCHEMBL16711168 | 0.77 | NUDT1 (0.67) | NUDT1HRH4CYP2D6CYP2C19SMN1; SMN2 | |
| SCHEMBL1318447 | 0.77 | NUDT1 (0.67) | NUDT1HRH4CYP2D6CYP2C19SMN1; SMN2 | |
| Isopropylamine SCHEMBL28920760 | 0.77 | HRH4 (0.48) | NUDT1HRH4CYP2D6CYP2C19MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5280009-A | Herbicide | BASF AKTIENGESELLSCHAFT (DE) | 1994-01-18 | — | — | US | disclosed |
| EP-0523533-A1 | Substituted pyrimidin derivatives and their use for combatting the growth of undesirable plants | BASF Aktiengesellschaft (DE) | 1993-01-20 | — | — | EP | disclosed |