Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | LMNA | P02545 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | WDR5 | P61964 | 2/20 | 0.43 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | IDE | P14735 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | NPY1R | P25929 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 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 | |
|---|---|---|---|---|
| SCHEMBL3040297 | 1.00 | KMT2A (0.43) | KMT2ALMNAMAPTALDH1A1HPGD | |
| SCHEMBL29752537 | 0.98 | KMT2A (0.43) | KMT2ALMNAMAPTALDH1A1HPGD | |
| SCHEMBL27264013 | 0.96 | KMT2A (0.41) | KMT2ALMNAMAPTALDH1A1HPGD | |
| SCHEMBL24520493 | 0.81 | MAPT (0.49) | KMT2ALMNAMAPTALDH1A1HPGD | |
| SCHEMBL1308045 | 0.81 | KMT2A (0.49) | KMT2ALMNAMAPTALDH1A1HPGD | |
| SCHEMBL2986517 | 0.80 | MCHR1 (0.41) | KMT2ALMNAMAPTALDH1A1HPGD | |
| SCHEMBL1307697 | 0.80 | MAPT (0.48) | KMT2ALMNAMAPTALDH1A1HPGD | |
| SCHEMBL31361956 | 0.80 | MAPT (0.48) | KMT2ALMNAMAPTALDH1A1HPGD | |
| SCHEMBL29645275 | 0.80 | MAPT (0.48) | KMT2ALMNAMAPTALDH1A1HPGD | |
| SCHEMBL23618526 | 0.80 | KMT2A (0.40) | KMT2ALMNAMAPTALDH1A1HPGD |
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-111704573-B | Preparation method of rabeprazole chloride and intermediate thereof | 珠海润都制药股份有限公司 | 2022-07-08 | — | — | CN | disclosed |
| CN-109134354-B | Synthesis method of 2-pyridylmethyl thioether and synthesis process of related drugs | 天津科技大学 | 2022-03-25 | — | — | CN | disclosed |