Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.45 |
| ▸ | DHODH | Q02127 | 1/20 | 0.41 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | KCNA3 | P22001 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | ELANE | P08246 | 1/20 | 0.36 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.36 |
| ▸ | EIF4E | P06730 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28981732 | 1.00 | BTK (0.45) | BTKDHODHFFAR4PDE10ALMNA | |
| SCHEMBL28981528 | 0.75 | DHODH (0.46) | BTKDHODHFFAR4PDE10ATSHR | |
| SCHEMBL27808178 | 0.72 | DHODH (0.43) | BTKDHODHFFAR4PDE10AHDAC6 | |
| SCHEMBL25754941 | 0.72 | BTK (0.55) | BTKDHODHFFAR4PDE10ALMNA | |
| SCHEMBL899865 | 0.70 | TSHR (0.45) | LMNAGAATSHRHTTL3MBTL1 | |
| SCHEMBL29092953 | 0.70 | DHODH (0.49) | BTKDHODHFFAR4PDE10AHTT | |
| SCHEMBL28981730 | 0.69 | DHODH (0.46) | BTKDHODHFFAR4TSHRHTT | |
| SCHEMBL30556731 | 0.69 | BTK (0.42) | BTKDHODHFFAR4PDE10AHDAC6 | |
| SCHEMBL29092980 | 0.69 | BTK (0.42) | BTKDHODHFFAR4PDE10AHDAC6 | |
| SCHEMBL7899073 | 0.69 | DHODH (0.56) | BTKDHODHLMNAGAATSHR |
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-110066271-B | Pyrrole derivative, preparation method thereof, pharmaceutical composition and application thereof | 上海迪诺医药科技有限公司 | 2023-04-07 | — | — | CN | disclosed |