Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 2/20 | 0.44 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.43 |
| ▸ | PNMT | P11086 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.35 |
| ▸ | BAD | Q92934 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 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 | |
|---|---|---|---|---|
| SCHEMBL29625282 | 0.86 | BCL2L1 (0.47) | NOTUMTRPA1PNMTTSHRDRD2 | |
| SCHEMBL29740371 | 0.86 | BCL2L1 (0.52) | NOTUMTRPA1PNMTTSHRALDH1A1 | |
| SCHEMBL9455906 | 0.86 | BCL2L1 (0.47) | NOTUMTRPA1PNMTTSHRDRD2 | |
| SCHEMBL2507445 | 0.86 | BCL2L1 (0.52) | NOTUMTRPA1PNMTTSHRALDH1A1 | |
| SCHEMBL26484320 | 0.85 | BCL2L1 (0.50) | NOTUMTRPA1PNMTTSHRALDH1A1 | |
| Hydrochloric Acid SCHEMBL30405862 | 0.85 | BCL2L1 (0.45) | NOTUMTRPA1PNMTTSHRDRD2 | |
| SCHEMBL4825821 | 0.81 | NOTUM (0.49) | NOTUMTRPA1PNMTTSHRDRD2 | |
| SCHEMBL2322705 | 0.81 | HTR2C (0.59) | PNMTDRD2HTR2AHTR2CHTR2B | |
| SCHEMBL9190699 | 0.80 | CYP2A6 (0.48) | NOTUMTRPA1PNMTDRD2CA1 | |
| SCHEMBL21480514 | 0.80 | CYP2A6 (0.48) | NOTUMTRPA1PNMTTSHRDRD2 |
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-115557947-B | Pyrazolo [4,3-c ] pyridine derivative and application thereof in medicine | 成都百裕制药股份有限公司 | 2024-04-02 | — | — | CN | disclosed |
| CN-115557947-A | Pyrazolo [4,3-c ] pyridine derivative and application thereof in medicine | 成都百裕制药股份有限公司 | 2023-01-03 | — | — | CN | disclosed |