Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | GLP1R | P43220 | 1/20 | 0.40 |
| ▸ | SLC10A2 | Q12908 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | TARBP2 | Q15633 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21177166 | 0.70 | BRD4 (0.47) | ALDH1A1CYP1A2NPC1MAPTKDM4E | |
| SCHEMBL30040951 | 0.68 | KDM4E (0.51) | ALDH1A1CYP1A2KMT2ANPC1MEN1 | |
| SCHEMBL22213904 | 0.68 | HTT (0.47) | ALDH1A1CYP1A2KMT2AMEN1MAPT | |
| SCHEMBL15614506 | 0.68 | KDM4E (0.40) | ALDH1A1CYP1A2KMT2ANPC1MEN1 | |
| SCHEMBL1498218 | 0.66 | TSHR (0.59) | ALDH1A1CYP1A2KMT2ANPC1MEN1 | |
| SCHEMBL4294216 | 0.66 | KMT2A (0.46) | ALDH1A1KMT2ANPC1MEN1MAPT | |
| SCHEMBL28979284 | 0.66 | GAA (0.52) | ALDH1A1CYP1A2KMT2ANPC1MEN1 | |
| SCHEMBL7233421 | 0.66 | NPC1 (0.54) | ALDH1A1CYP1A2KMT2ANPC1MEN1 | |
| SCHEMBL1431368 | 0.66 | ALDH1A1 (0.47) | ALDH1A1CYP1A2KMT2ANPC1MEN1 | |
| SCHEMBL166847 | 0.66 | SMN1; SMN2 (0.46) | ALDH1A1CYP1A2KMT2ANPC1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012076966-A1 | SUBSTITUTED THIENO [3,4-B] PYRAZINE COMPOUNDS | LUPIN LIMITED (IN) | 2012-06-14 | — | — | WO | disclosed |
| WO-2012076966-A1 | SUBSTITUTED THIENO [3,4-B] PYRAZINE COMPOUNDS | LUPIN LIMITED (IN) | 2012-06-14 | — | — | WO | disclosed |