Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.76 |
| ▸ | RAPGEF4 | Q8WZA2 | 3/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.62 |
| ▸ | PKM | P14618 | 1/20 | 0.58 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.53 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.53 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.53 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.53 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.53 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.53 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.53 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.53 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.53 |
| ▸ | ENPP3 | O14638 | 2/20 | 0.51 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.44 |
| ▸ | HTR6 | P50406 | 1/20 | 0.42 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.41 |
| ▸ | ENPP1 | P22413 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4532804 | 0.87 | L3MBTL1 (1.00) | L3MBTL1RAPGEF4CYP2C19PKMHDAC3 | |
| SCHEMBL1714526 | 0.87 | L3MBTL1 (1.00) | L3MBTL1RAPGEF4CYP2C19PKMHDAC3 | |
| SCHEMBL30365350 | 0.87 | L3MBTL1 (1.00) | L3MBTL1RAPGEF4CYP2C19PKMHDAC3 | |
| SCHEMBL27942418 | 0.86 | L3MBTL1 (0.68) | L3MBTL1RAPGEF4CYP2C19PKMHDAC3 | |
| SCHEMBL28022275 | 0.86 | L3MBTL1 (0.64) | L3MBTL1RAPGEF4CYP2C19PKMHDAC3 | |
| SCHEMBL28072743 | 0.80 | L3MBTL1 (0.57) | L3MBTL1RAPGEF4CYP2C19PKMHDAC3 | |
| SCHEMBL27958491 | 0.80 | CYP2C19 (0.65) | L3MBTL1RAPGEF4CYP2C19PKMHDAC3 | |
| SCHEMBL1773294 | 0.78 | CYP2C19 (1.00) | L3MBTL1RAPGEF4CYP2C19PKMHDAC3 | |
| SCHEMBL15175383 | 0.77 | RAPGEF4 (1.00) | L3MBTL1RAPGEF4CYP2C19PKMHDAC3 | |
| SCHEMBL28090729 | 0.76 | MET (0.70) | L3MBTL1RAPGEF4CYP2C19HTR6ALDH1A1 |
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-101678022-A | 5-cyano-4- (pyrrolo [2,3b ] pyridin-3-yl) pyrimidine derivatives useful as protein kinase inhibitors | VERTEX PHARMA | 2010-03-24 | — | — | CN | disclosed |