Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
| ▸ | ADK | P55263 | 1/20 | 0.33 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.33 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.33 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30371 | 0.88 | — | — | |
| Hydrogen Sulfide SCHEMBL27780233 | 0.86 | — | — | |
| Carbamic Acid SCHEMBL27921000 | 0.85 | NPC1 (0.43) | KMT2ANPC1RAB9ABAZ2BCSNK1A1 | |
| Pyridine SCHEMBL6603891 | 0.81 | CSNK1A1 (0.42) | KMT2ANPC1RAB9AMTORADK | |
| Pyridine SCHEMBL9978894 | 0.81 | CSNK1A1 (0.42) | KMT2ANPC1RAB9AMTORADK | |
| SCHEMBL28222175 | 0.81 | PDE4A (0.37) | KMT2ANPC1RAB9ABAZ2BCSNK1A1 | |
| Pyridine SCHEMBL6603492 | 0.77 | KMT2A (0.45) | KMT2ANPC1RAB9AMTORADK | |
| Piperazine SCHEMBL28251008 | 0.76 | CSNK1A1 (0.39) | KMT2ANPC1RAB9ACSNK1A1TYRO3 | |
| Quinoline SCHEMBL27521930 | 0.74 | ALDH1A1 (0.52) | KMT2ANPC1RAB9ATSHRCSNK1A1 | |
| SCHEMBL4765851 | 0.73 | — | — |
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-105218540-B | A kind of preparation method of 3 thiocarbamoyl imidazoles of C simultaneously [1,2 a] pyridine compounds and their | 曲阜师范大学 | 2017-07-04 | — | — | CN | disclosed |
| CN-105218540-A | The preparation method of a kind of C-3 position thiocarbamoyl imidazole also [1,2-a] pyridine compounds and their | UNIV QUFU NORMAL | 2016-01-06 | — | — | CN | disclosed |