Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX4 | Q96LA9 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | FABP3 | P05413 | 2/20 | 0.39 |
| ▸ | FABP4 | P15090 | 2/20 | 0.39 |
| ▸ | FABP5 | Q01469 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CCR2 | P41597 | 1/20 | 0.39 |
| ▸ | CCR4 | P51679 | 1/20 | 0.39 |
| ▸ | CCR5 | P51681 | 1/20 | 0.39 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PTK2B | Q14289 | 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 | |
|---|---|---|---|---|
| SCHEMBL10517861 | 0.83 | HTT (0.50) | CYP1A2CYP3A4CYP2D6CYP2C19HTT | |
| SCHEMBL1984974 | 0.81 | HTT (0.53) | MRGPRX4CYP1A2HTTCYP2C9KMT2A | |
| SCHEMBL28178718 | 0.77 | MRGPRX4 (0.46) | MRGPRX4CYP1A2HTTTP53CYP2C9 | |
| SCHEMBL1989711 | 0.76 | L3MBTL1 (0.50) | MRGPRX4L3MBTL1HTTKMT2AALDH1A1 | |
| SCHEMBL21729951 | 0.75 | CYP1A2 (0.41) | CYP1A2CYP3A4CYP2D6CYP2C19L3MBTL1 | |
| SCHEMBL1987451 | 0.75 | HTT (0.54) | FABP3FABP4FABP5HTTTP53 | |
| SCHEMBL28142083 | 0.74 | MRGPRX4 (0.46) | MRGPRX4L3MBTL1HTTKMT2AALDH1A1 | |
| SCHEMBL15344604 | 0.74 | KMT2A (0.50) | CYP3A4KMT2AALDH1A1MAPTPTK2B | |
| SCHEMBL18284643 | 0.73 | ALDH1A1 (0.60) | CYP1A2CYP3A4CYP2C19L3MBTL1CYP2C9 | |
| SCHEMBL1355391 | 0.72 | ALDH1A1 (0.52) | MRGPRX4ALDH1A1MAPTSMN1; SMN2 |
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-0315889-B1 | Pyrimidine derivatives, processes for their production, and herbicidal method and compositions | KUMIAI CHEMICAL INDUSTRY CO (JP) | 1996-07-17 | — | — | EP | disclosed |
| US-4923501-A | COTTON; NONPHYTOTOXIC | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 1990-05-08 | — | — | US | disclosed |
| EP-0315889-A2 | Pyrimidine derivatives, processes for their production, and herbicidal method and compositions | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 1989-05-17 | — | — | EP | disclosed |