Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | MPO | P05164 | 1/20 | 0.49 |
| ▸ | NOS1 | P29475 | 6/20 | 0.47 |
| ▸ | NOS3 | P29474 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.46 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.45 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.45 |
| ▸ | IDO1 | P14902 | 2/20 | 0.44 |
| ▸ | AGXT | P21549 | 2/20 | 0.44 |
| ▸ | APP | P05067 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9395340 | 0.82 | KCNH3 (0.47) | RAB9AMPONOS1NOS3L3MBTL1 | |
| SCHEMBL28000659 | 0.82 | NPC1 (0.47) | NPC1RAB9AMPONOS1NOS3 | |
| SCHEMBL28824419 | 0.81 | ADORA2A (0.47) | MPONOS1NOS3APP | |
| SCHEMBL3922881 | 0.81 | IDO1 (0.51) | NPC1RAB9AMPONOS1NOS3 | |
| SCHEMBL1402167 | 0.80 | BACE1 (0.50) | NOS1NOS3L3MBTL1TLR8APP | |
| SCHEMBL29758354 | 0.80 | BACE1 (0.50) | NOS1NOS3L3MBTL1TLR8APP | |
| SCHEMBL4677 | 0.79 | TAAR1 (0.42) | NPC1RAB9AMPOTAAR1TLR8 | |
| SCHEMBL28816865 | 0.79 | NPC1 (0.47) | NPC1RAB9AMPONOS1NOS3 | |
| SCHEMBL21383967 | 0.78 | L3MBTL1 (0.45) | NPC1RAB9AMPONOS1NOS3 | |
| SCHEMBL10569673 | 0.78 | MPO (0.55) | NPC1RAB9AMPONOS1NOS3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105324380-A | Pyrrolo[2,3-b]pyridine cdk9 kinase inhibitors | ABBVIE INC | 2016-02-10 | — | — | CN | disclosed |
| CN-105246890-A | Pyrrolo[2, 3-b]pyridine cdk9 kinase inhibitors | ABBVIE INC | 2016-01-13 | — | — | CN | disclosed |
| CN-102482218-B | Pyridine And Pyrazine Derivatives As Protein Kinase Modulators | NOVARTIS AG | 2015-01-21 | — | — | CN | disclosed |