Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | NOS3 | P29474 | 1/20 | 0.43 |
| ▸ | NOS2 | P35228 | 1/20 | 0.43 |
| ▸ | PIM1 | P11309 | 1/20 | 0.42 |
| ▸ | ABL1 | P00519 | 1/20 | 0.41 |
| ▸ | BCR | P11274 | 1/20 | 0.41 |
| ▸ | KDM2B | Q8NHM5 | 2/20 | 0.39 |
| ▸ | METAP2 | P50579 | 1/20 | 0.39 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | LTA4H | P09960 | 2/20 | 0.37 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | ALPL | P05186 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL31375568 | 0.84 | HDAC1 (0.43) | HDAC1KDM1ANOS3NOS2PIM1 | |
| SCHEMBL30767604 | 0.84 | HDAC1 (0.43) | HDAC1KDM1ANOS3NOS2PIM1 | |
| SCHEMBL30767625 | 0.84 | HDAC1 (0.46) | HDAC1KDM1ANOS3NOS2PIM1 | |
| SCHEMBL27764812 | 0.83 | KIF11 (0.52) | HDAC1KDM1ANOS3NOS2ABL1 | |
| SCHEMBL29473433 | 0.81 | CTSS (0.44) | METAP2ALDH1A1GAAL3MBTL1LTA4H | |
| SCHEMBL31375591 | 0.81 | ABL1 (0.49) | HDAC1KDM1ANOS3NOS2PIM1 | |
| SCHEMBL28726704 | 0.80 | NOS3 (0.48) | HDAC1KDM1ANOS3NOS2ABL1 | |
| SCHEMBL24168950 | 0.78 | NOS3 (0.56) | HDAC1KDM1ANOS3NOS2ABL1 | |
| SCHEMBL28726706 | 0.78 | NOS3 (0.47) | HDAC1KDM1ANOS3NOS2ABL1 | |
| SCHEMBL17412625 | 0.78 | KIF11 (0.52) | HDAC1KDM1ANOS3NOS2ABL1 |
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-110156668-B | Method for synthesizing 4-polyfluoroalkyl-2, 6-diaryl substituted pyridine compound | 福州大学 | 2022-04-26 | — | — | CN | disclosed |