Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.62 |
| ▸ | TSHR | P16473 | 1/20 | 0.62 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2927687 | 1.00 | ALDH1A1 (0.62) | ALDH1A1TSHRHTTKMT2ASMN1; SMN2 | |
| SCHEMBL6751634 | 0.86 | ALDH1A1 (0.55) | ALDH1A1TSHRHTTKMT2ASMN1; SMN2 | |
| SCHEMBL29098857 | 0.86 | ALDH1A1 (0.54) | ALDH1A1TSHRHTTKMT2ASMN1; SMN2 | |
| SCHEMBL27266784 | 0.82 | ALDH1A1 (0.47) | ALDH1A1TSHRHTTKMT2ASMN1; SMN2 | |
| SCHEMBL31625977 | 0.82 | ALDH1A1 (0.47) | ALDH1A1TSHRHTTKMT2ASMN1; SMN2 | |
| SCHEMBL29336758 | 0.82 | ALDH1A1 (0.50) | ALDH1A1TSHRHTTKMT2ASMN1; SMN2 | |
| SCHEMBL15848349 | 0.82 | ALDH1A1 (0.50) | ALDH1A1TSHRHTTKMT2ASMN1; SMN2 | |
| SCHEMBL12323847 | 0.80 | ALDH1A1 (0.45) | ALDH1A1TSHRHTTKMT2ASMN1; SMN2 | |
| SCHEMBL10983149 | 0.80 | CA9 (0.48) | ALDH1A1TSHRKMT2AMEN1KDM4E | |
| SCHEMBL4001984 | 0.80 | ALDH1A1 (0.43) | ALDH1A1TSHRHTTKMT2ACYP2C19 |
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-2013052362-A1 | HEPATITIS C VIRUS INHIBITORS | ENANTA PHARMACEUTICALS, INC. (US) | 2013-04-11 | — | — | WO | disclosed |