Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.68 |
| ▸ | CA1 | P00915 | 3/20 | 0.59 |
| ▸ | CA2 | P00918 | 3/20 | 0.59 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.59 |
| ▸ | PARP1 | P09874 | 1/20 | 0.59 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.59 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | NPC1 | O15118 | 2/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | RELA | Q04206 | 1/20 | 0.54 |
| ▸ | CES2 | O00748 | 1/20 | 0.52 |
| ▸ | CES1 | P23141 | 1/20 | 0.52 |
| ▸ | NOS3 | P29474 | 2/20 | 0.52 |
| ▸ | MAOA | P21397 | 1/20 | 0.51 |
| ▸ | MAOB | P27338 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Acetamide SCHEMBL27854677 | 0.98 | ACHE (0.65) | ACHECA1CA2PARP10PARP1 | |
| Methyl Carbamate SCHEMBL28653549 | 0.89 | ACHE (0.65) | ACHECA1CA2PARP10PARP1 | |
| Acetic Acid SCHEMBL28408918 | 0.88 | ACHE (0.71) | ACHECA1CA2PARP10PARP1 | |
| Bicarbonate SCHEMBL2285222 | 0.86 | ACHE (0.75) | ACHECA1CA2PARP10PARP1 | |
| Bicarbonate SCHEMBL722688 | 0.86 | ACHE (0.75) | ACHECA1CA2PARP10PARP1 | |
| SCHEMBL28067219 | 0.85 | ACHE (0.83) | ACHECA1CA2LMNANPC1 | |
| SCHEMBL8406724 | 0.85 | PARP10 (0.84) | ACHECA1CA2PARP10PARP1 | |
| Methyl Alcohol SCHEMBL20136156 | 0.83 | ACHE (0.88) | ACHECA1CA2LMNANPC1 | |
| SCHEMBL19182839 | 0.83 | ACHE (1.00) | ACHECA1CA2LMNANPC1 | |
| SCHEMBL12464 | 0.83 | — | — |
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-109535017-A | A kind of VENLAFAXINE HCL preparation method | 合肥立方制药股份有限公司 | 2019-03-29 | — | — | CN | disclosed |