Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR5 | Q9H228 | 4/20 | 0.50 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.50 |
| ▸ | MAOB | P27338 | 9/20 | 0.48 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.47 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 5/20 | 0.47 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.47 |
| ▸ | PARP15 | Q460N3 | 2/20 | 0.46 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.46 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | PPARA | Q07869 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | FAAH | O00519 | 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 | |
|---|---|---|---|---|
| SCHEMBL29288229 | 0.88 | S1PR5 (0.65) | S1PR5S1PR1MAOBMAOAPDGFRA | |
| SCHEMBL29288202 | 0.87 | HRH3 (0.53) | S1PR5S1PR1MAOBFFAR1FFAR4 | |
| SCHEMBL29288219 | 0.81 | HRH3 (0.52) | S1PR5S1PR1MAOBMAOAHTR2A | |
| SCHEMBL3039290 | 0.80 | S1PR5 (0.77) | S1PR5S1PR1MAOBFFAR1FFAR4 | |
| SCHEMBL23004617 | 0.79 | MAOB (0.52) | MAOBFFAR1FFAR4MAOAPARP15 | |
| SCHEMBL29288196 | 0.79 | MAOB (0.76) | S1PR5S1PR1MAOBFFAR1FFAR4 | |
| SCHEMBL21348251 | 0.77 | HRH3 (0.66) | MAOBFFAR1FFAR4CA12CA9 | |
| SCHEMBL3034002 | 0.77 | HRH3 (0.61) | MAOBFFAR1FFAR4MAOAPARP15 | |
| SCHEMBL2019824 | 0.71 | MAOB (0.76) | MAOBFFAR1FFAR4MAOAPARP15 | |
| SCHEMBL30398583 | 0.71 | MAOB (0.76) | MAOBFFAR1FFAR4MAOAPARP15 |
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-108912029-B | Nitrogen-containing heterocyclic amide derivative and use thereof | 广东东阳光药业有限公司 | 2021-10-01 | — | — | CN | disclosed |