Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | XBP1 | P17861 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | DHPS | P49366 | 1/20 | 0.33 |
| ▸ | TNKS | O95271 | 1/20 | 0.33 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.33 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL336435 | 0.82 | PDE4B (0.38) | CYP1A2KMT2ARAB9ANPC1MEN1 | |
| SCHEMBL28340606 | 0.81 | NFE2L2 (0.36) | RAB9ANPC1SLC6A4SLC6A3DHPS | |
| SCHEMBL28851148 | 0.79 | HRH3 (0.43) | — | |
| SCHEMBL27685414 | 0.78 | PTGS2 (0.38) | KMT2ARAB9AMEN1KDM4EL3MBTL1 | |
| SCHEMBL5791944 | 0.78 | PTGS2 (0.43) | KMT2ARAB9AMEN1L3MBTL1SMN1; SMN2 | |
| SCHEMBL2937510 | 0.75 | CYP1A2 (0.39) | CYP1A2KMT2ARAB9ANPC1MEN1 | |
| SCHEMBL27877116 | 0.73 | CYP2A6 (0.36) | KMT2ARAB9ANPC1MEN1KDM4E | |
| SCHEMBL57641 | 0.72 | ALDH1A1 (0.41) | CYP1A2KDM4ECYP3A4CYP2D6CYP2C19 | |
| SCHEMBL158204 | 0.71 | — | — | |
| SCHEMBL27720358 | 0.70 | ALDH1A1 (0.39) | CYP1A2KDM4ECYP3A4CYP2D6CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105007734-A | Process for preparing 4-amino-5-fluoro-3-chloro-6- (substituted) picolinates | DOW AGROSCIENCES LLC | 2015-10-28 | — | — | CN | disclosed |