Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.40 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.40 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | IL18 | Q14116 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HRH2 | P25021 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 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 | |
|---|---|---|---|---|
| SCHEMBL15584628 | 1.00 | KDM4E (0.41) | KDM4EPARP15PARP10PARP2LMNA | |
| SCHEMBL18442518 | 0.88 | KDM4E (0.39) | KDM4EKMT2AMEN1ALDH1A1HRH2 | |
| SCHEMBL21745759 | 0.87 | POLB (0.45) | KDM4EPARP15PARP10PARP2LMNA | |
| SCHEMBL14405700 | 0.86 | RAB9A (0.49) | RAB9A | |
| SCHEMBL23222487 | 0.84 | PARP15 (0.43) | KDM4EPARP15PARP10PARP2LMNA | |
| SCHEMBL21745527 | 0.84 | PLAAT3 (0.41) | ALDH1A1SCN9A | |
| SCHEMBL17052788 | 0.84 | CYP19A1 (0.47) | KDM4EPARP15PARP10PARP2LMNA | |
| SCHEMBL21745760 | 0.83 | PARP15 (0.46) | KDM4EPARP15PARP10PARP2LMNA | |
| SCHEMBL29700357 | 0.83 | PARP15 (0.46) | KDM4EPARP15PARP10PARP2LMNA | |
| SCHEMBL17420502 | 0.80 | ALDH1A1 (0.47) | KDM4EMAPTPOLBRAB9AKMT2A |
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-109678791-B | 1- (2, 4-difluorophenyl) -2, 2-difluoro-2- (5-substituted pyridine-2-yl) ethanone and preparation method thereof | 美国陶氏益农公司 | 2022-07-01 | — | — | CN | disclosed |