Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | CCNE1 | P24864 | 5/20 | 0.38 |
| ▸ | CDK2 | P24941 | 5/20 | 0.38 |
| ▸ | CDK3 | Q00526 | 5/20 | 0.38 |
| ▸ | NPC1 | O15118 | 4/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | CDK1 | P06493 | 2/20 | 0.36 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.36 |
| ▸ | GRK2 | P25098 | 2/20 | 0.35 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
| ▸ | FFAR2 | O15552 | 3/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.34 |
| ▸ | FSCN1 | Q16658 | 1/20 | 0.34 |
| ▸ | FPR2 | P25090 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30944292 | 1.00 | ADORA1 (0.39) | ADORA1CNR1CCNE1CDK2CDK3 | |
| SCHEMBL30944315 | 0.85 | P2RX7 (0.47) | CNR1NPC1RAB9AKMT2ACNR2 | |
| SCHEMBL30944357 | 0.82 | ADORA1 (0.56) | ADORA1CCNE1CDK2CDK3NPC1 | |
| SCHEMBL28523749 | 0.81 | ADORA1 (0.55) | ADORA1CCNE1CDK2CDK3NPC1 | |
| SCHEMBL30944297 | 0.81 | ADORA1 (0.55) | ADORA1CCNE1CDK2CDK3NPC1 | |
| SCHEMBL28512789 | 0.81 | DYRK1A (0.58) | NPC1RAB9AMEN1KMT2ADYRK1A | |
| SCHEMBL30944286 | 0.81 | DYRK1A (0.58) | NPC1RAB9AMEN1KMT2ADYRK1A | |
| SCHEMBL30944281 | 0.81 | NPC1 (0.55) | ADORA1CNR1NPC1RAB9AMEN1 | |
| SCHEMBL28521684 | 0.81 | NPC1 (0.55) | ADORA1CNR1NPC1RAB9AMEN1 | |
| SCHEMBL30944284 | 0.80 | NPC1 (0.40) | ADORA1CNR1CCNE1CDK2CDK3 |
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-112423746-A | Novel anti-mycobacterial heterocyclic amides | 克莱斯通公司 | 2021-02-26 | — | — | CN | claimed |
| CN-112423746-A | Novel anti-mycobacterial heterocyclic amides | 克莱斯通公司 | 2021-02-26 | — | — | CN | disclosed |