Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | PRKCA | P17252 | 1/20 | 0.43 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3507472 | 0.93 | AOC3 (0.49) | TSHRAOC3KMT2ALTA4HMEN1 | |
| SCHEMBL13410636 | 0.83 | IDO1 (0.50) | TSHRCYP2C9MAOBSMN1; SMN2NPC1 | |
| SCHEMBL12714251 | 0.83 | IDO1 (0.50) | TSHRCYP2C9MAOBSMN1; SMN2NPC1 | |
| SCHEMBL14461599 | 0.83 | LMNA (0.53) | TSHRCYP2C9GAAKMT2AMEN1 | |
| SCHEMBL23423410 | 0.82 | MAPT (0.43) | TSHRCYP2C9KMT2AMEN1LMNA | |
| SCHEMBL872642 | 0.82 | MAPT (0.43) | TSHRCYP2C9KMT2AMEN1LMNA | |
| SCHEMBL2781956 | 0.82 | MAPT (0.43) | TSHRCYP2C9KMT2AMEN1LMNA | |
| SCHEMBL3813606 | 0.82 | TRPA1 (0.48) | TSHRCYP2C9KMT2AMEN1LMNA | |
| SCHEMBL647500 | 0.82 | TRPA1 (0.48) | TSHRCYP2C9KMT2AMEN1LMNA | |
| SCHEMBL647501 | 0.82 | TRPA1 (0.48) | TSHRCYP2C9KMT2AMEN1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1987037-A2 | FUSED HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2008-11-05 | — | — | EP | disclosed |
| WO-2007097470-A2 | FUSED NITROGEN- COMPRISING HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-08-30 | — | — | WO | disclosed |