Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 3/20 | 0.34 |
| ▸ | CA1 | P00915 | 3/20 | 0.34 |
| ▸ | CA2 | P00918 | 3/20 | 0.34 |
| ▸ | CA9 | Q16790 | 3/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28114959 | 0.77 | KMT2A (0.44) | ALDH1A1CYP1A2CYP2D6CYP2C19CYP3A4 | |
| SCHEMBL6205026 | 0.74 | TDP1 (0.44) | ALDH1A1CYP1A2MAPTCYP3A4BLM | |
| SCHEMBL4332774 | 0.74 | ALDH1A1 (0.40) | ALDH1A1CYP1A2MAPTCYP3A4BLM | |
| SCHEMBL28031055 | 0.73 | ALDH1A1 (0.35) | ALDH1A1MAPTCYP3A4BLMPMP22 | |
| SCHEMBL21224681 | 0.71 | CA2 (0.38) | ALDH1A1CYP1A2CYP2D6CYP2C19TRPM8 | |
| SCHEMBL3347421 | 0.71 | ALDH1A1 (0.47) | ALDH1A1MAPTCYP3A4POLBKMT2A | |
| SCHEMBL11228223 | 0.71 | TRPM8 (0.48) | ALDH1A1CYP1A2TRPM8POLBKMT2A | |
| SCHEMBL27676745 | 0.71 | CYP1A2 (0.41) | ALDH1A1CYP1A2MAPTCYP3A4BLM | |
| SCHEMBL28114930 | 0.71 | KMT2A (0.44) | ALDH1A1CYP1A2CYP2D6CYP2C19MAPT | |
| SCHEMBL28114928 | 0.71 | ALDH1A1 (0.37) | ALDH1A1MAPTCYP3A4BLMPMP22 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1187339-C | Method for producing 4,6-disubstituted 2-isocyanatopyrimidines and to their use as intermediate products for active ingredient syntheses | AVENTIES CROPS SCIENCE GMBH (DE) | 2005-02-02 | — | — | CN | disclosed |
| CN-1311782-A | Method for producing 4,6-disubstituted 2-isocyanatopyrimidines and to their use as intermediate products for active ingredient syntheses | AVENTIES CROPS SCIENCE GMBH (DE) | 2001-09-05 | — | — | CN | disclosed |
| EP-1097144-A1 | METHOD FOR PRODUCING 4,6-DISUBSTITUTED 2-ISOCYANATOPYRIMIDINES AND TO THEIR USE AS INTERMEDIATE PRODUCTS FOR ACTIVE INGREDIENT SYNTHESES | Aventis CropScience GmbH (DE) | 2001-05-09 | — | — | EP | disclosed |
| WO-2000005220-A1 | METHOD FOR PRODUCING 4,6-DISUBSTITUTED 2-ISOCYANATOPYRIMIDINES AND TO THEIR USE AS INTERMEDIATE PRODUCTS FOR ACTIVE INGREDIENT SYNTHESES | AVENTIS CROPSCIENCE GMBH (DE) | 2000-02-03 | — | — | WO | disclosed |