Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.57 |
| ▸ | NPC1 | O15118 | 1/20 | 0.57 |
| ▸ | RAB9A | P51151 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11639923 | 0.74 | ALDH1A1 (0.45) | KDM4ENPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL29025982 | 0.74 | KDM4E (0.41) | KDM4ENPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL3718245 | 0.73 | KDM4E (1.00) | KDM4ENPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL29025990 | 0.72 | KDM4E (0.40) | KDM4ENPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL28352391 | 0.70 | NPC1 (0.58) | KDM4ENPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL28352445 | 0.69 | KDM4E (0.37) | KDM4ENPC1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL28356105 | 0.69 | HEXA (0.37) | KDM4EHPGDALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL834546 | 0.68 | CA1 (0.61) | KDM4ENPC1RAB9AMEN1KMT2A | |
| SCHEMBL12203937 | 0.66 | NQO1 (0.67) | KDM4ENPC1SMN1; SMN2HPGDALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL7995827 | 0.66 | CA1 (0.58) | KDM4ENPC1RAB9AMEN1KMT2A |
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-110770209-B | Novel 5-hydroxypyridine compounds useful as P2X1 and P2X3 receptor antagonists and pharmaceutical compositions containing the same | 光州科学技术院 | 2023-06-30 | — | — | CN | disclosed |