Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LOXL2 | Q9Y4K0 | 3/20 | 0.58 |
| ▸ | LTA4H | P09960 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.50 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | MPO | P05164 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.47 |
| ▸ | F10 | P00742 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7150384 | 0.87 | HDAC3 (0.61) | LOXL2LMNAHDAC6HDAC3NCOR2 | |
| Hydrochloric Acid SCHEMBL8833446 | 0.85 | HDAC3 (0.59) | LOXL2LMNAHDAC6HDAC3NCOR2 | |
| SCHEMBL725064 | 0.80 | KMT2A (0.80) | LTA4HLMNAKMT2AMEN1NPSR1 | |
| SCHEMBL203283 | 0.79 | ALDH1A1 (0.61) | LOXL2LMNAKMT2AMEN1HDAC6 | |
| Hydrochloric Acid SCHEMBL28795867 | 0.78 | KMT2A (0.76) | LTA4HLMNAKMT2AMEN1NPSR1 | |
| Hydrochloric Acid SCHEMBL2450035 | 0.78 | ALDH1A1 (0.58) | LOXL2LMNAKMT2AMEN1HDAC6 | |
| Isonicotinic Acid SCHEMBL9986818 | 0.77 | NAPRT (0.63) | LOXL2KMT2AMEN1KDM4EMPO | |
| Carbamic Acid SCHEMBL31175940 | 0.77 | LOXL2 (0.73) | LOXL2KDM4EMPOCYP1A2CYP3A4 | |
| SCHEMBL177830 | 0.77 | LMNA (0.63) | LTA4HLMNAKMT2AMEN1NPSR1 | |
| SCHEMBL4190482 | 0.77 | LMNA (0.63) | LTA4HLMNAKMT2AMEN1NPSR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100448846-C | Method for catalytic hydrogenation of acyl pyridine to preparing substituted pyridine compound hydrochlorate | UNIV TSINGHUA (CN) | 2009-01-07 | — | — | CN | disclosed |
| CN-1995017-A | Method for catalytic hydrogenation of acyl pyridine to preparing substituted pyridine compound hydrochlorate | UNIV TSINGHUA (CN) | 2007-07-11 | — | — | CN | disclosed |