Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.35 |
| ▸ | EGLN1 | Q9GZT9 | 5/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.34 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.34 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.34 |
| ▸ | F2 | P00734 | 2/20 | 0.34 |
| ▸ | F10 | P00742 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4493594 | 0.96 | GAA (0.39) | GAAALDH1A1SMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL4490423 | 0.92 | GAA (0.42) | GAAALDH1A1SMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL6032330 | 0.86 | KEAP1 (0.33) | GAAALDH1A1SMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL4502970 | 0.75 | EGLN1 (0.45) | GAAALDH1A1SMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL5814580 | 0.75 | TNIK (0.33) | EGLN1 | |
| SCHEMBL4477518 | 0.73 | GAA (0.42) | GAAALDH1A1SMN1; SMN2CYP1A2CYP2C19 | |
| SCHEMBL4484200 | 0.73 | LMNA (0.36) | ALDH1A1SMN1; SMN2LMNAKMT2APOLB | |
| SCHEMBL1335829 | 0.72 | MEN1 (0.37) | ALDH1A1SMN1; SMN2LMNAKMT2AMEN1 | |
| SCHEMBL4502946 | 0.71 | AKR1B1 (0.43) | ALDH1A1SMN1; SMN2EGLN1LMNAKMT2A | |
| SCHEMBL5438443 | 0.70 | GAA (0.42) | GAAALDH1A1SMN1; SMN2CYP1A2CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005087767-A1 | HIV INTEGRASE INHIBITORS | MERCK & CO., INC. (US) | 2005-09-22 | — | — | WO | disclosed |