Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MKNK2 | Q9HBH9 | 3/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | CARM1 | Q86X55 | 2/20 | 0.33 |
| ▸ | PRMT6 | Q96LA8 | 2/20 | 0.33 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.32 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL23070818 | 1.00 | SMN1; SMN2 (0.37) | SMN1; SMN2CYP1A2KDM4ELMNAMKNK2 | |
| SCHEMBL23070821 | 1.00 | SMN1; SMN2 (0.37) | SMN1; SMN2CYP1A2KDM4ELMNAMKNK2 | |
| Hydrochloric Acid SCHEMBL31410913 | 0.99 | SMN1; SMN2 (0.36) | SMN1; SMN2CYP1A2KDM4ELMNAMKNK2 | |
| SCHEMBL29135634 | 0.82 | SMN1; SMN2 (0.40) | SMN1; SMN2CYP1A2KDM4ELMNAMKNK2 | |
| SCHEMBL29135636 | 0.82 | SMN1; SMN2 (0.40) | SMN1; SMN2CYP1A2KDM4ELMNAMKNK2 | |
| SCHEMBL28644208 | 0.79 | MEN1 (0.38) | SMN1; SMN2CYP1A2KDM4ELMNAPKM | |
| SCHEMBL28644209 | 0.79 | MEN1 (0.38) | SMN1; SMN2CYP1A2KDM4ELMNAPKM | |
| SCHEMBL20371087 | 0.79 | MCHR1 (0.39) | MKNK2DPP9 | |
| SCHEMBL20337804 | 0.78 | MTNR1A (0.42) | MKNK2CARM1PRMT6MTNR1AMTNR1B | |
| SCHEMBL29003585 | 0.78 | CYP1A2 (0.36) | SMN1; SMN2CYP1A2KDM4ELMNAMKNK2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113354653-A | Diaryl macrocyclic polymorphs and methods of making the same | 特普医药公司 | 2021-09-07 | — | — | CN | disclosed |
| CN-108026108-B | Diaryl macrocyclic polymorphs | 特普医药公司 | 2021-06-22 | — | — | CN | disclosed |
| WO-2021042890-A1 | HETEROCYCLIC COMPOUND AND APPLICATION THEREOF AS TRK KINASE INHIBITOR | 罗欣药业(上海)有限公司 | 2021-03-11 | — | — | WO | disclosed |
| CN-107735399-B | Chiral diaryl macrocycles as modulators of protein kinases | 特普医药公司 | 2021-01-26 | — | — | CN | disclosed |