Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD44 | P16070 | 2/20 | 0.72 |
| ▸ | PNMT | P11086 | 9/20 | 0.61 |
| ▸ | PRCP | P42785 | 1/20 | 0.56 |
| ▸ | MAOB | P27338 | 1/20 | 0.52 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.47 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.47 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.45 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3659651 | 1.00 | CD44 (0.72) | CD44PNMTPRCPMAOBADRA2A | |
| Hydrochloric Acid SCHEMBL4516826 | 0.98 | CD44 (0.70) | CD44PNMTPRCPMAOBADRA2A | |
| SCHEMBL11327051 | 0.89 | CD44 (0.62) | CD44PNMTPRCPMAOBHTR2C | |
| SCHEMBL509247 | 0.86 | CD44 (0.75) | CD44PNMTPRCPMAOBHTR2C | |
| SCHEMBL329571 | 0.84 | CD44 (1.00) | CD44PNMTPRCPMAOBHTR2C | |
| SCHEMBL29771844 | 0.84 | CD44 (1.00) | CD44PNMTPRCPMAOBHTR2C | |
| Hydrochloric Acid SCHEMBL4520528 | 0.82 | CD44 (0.96) | CD44PNMTPRCPMAOBHTR2C | |
| Hydrochloric Acid SCHEMBL4506036 | 0.82 | CD44 (0.96) | CD44PNMTPRCPMAOBHTR2C | |
| SCHEMBL329619 | 0.81 | CD44 (0.68) | CD44PNMTPRCPMAOB | |
| SCHEMBL29805405 | 0.81 | CD44 (0.68) | CD44PNMTPRCPMAOB |
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-113646049-B | Pyrimidinone derivatives as SHP2 antagonists | 默克专利有限公司 | 2024-08-13 | — | — | CN | disclosed |
| CN-117693507-A | Inhibitor compounds | 奈奥芬莱有限公司 | 2024-03-12 | — | — | CN | disclosed |
| CN-116806218-A | Sulfonamide and its use for the treatment of parasitic helminth infections and diseases | 新基公司 | 2023-09-26 | — | — | CN | disclosed |
| WO-2023002165-A1 | INHIBITOR COMPOUNDS | Neophore Limited (GB) | 2023-01-26 | — | — | WO | disclosed |