Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 18/20 | 0.44 |
| ▸ | ACACA | Q13085 | 17/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | IKBKB | O14920 | 1/20 | 0.36 |
| ▸ | CHUK | O15111 | 1/20 | 0.36 |
| ▸ | IKBKG | Q9Y6K9 | 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 | |
|---|---|---|---|---|
| SCHEMBL4724543 | 0.98 | ACACB (0.45) | ACACBACACACYP2C9IKBKBCHUK | |
| SCHEMBL3496627 | 0.94 | ACACB (0.52) | ACACBACACACYP2C9 | |
| SCHEMBL3497215 | 0.92 | ACACB (0.52) | ACACBACACACYP2C9 | |
| SCHEMBL4766278 | 0.91 | ACACB (0.48) | ACACBACACACYP2C9 | |
| SCHEMBL13312728 | 0.90 | ACACB (0.44) | ACACBACACACYP2C9IKBKBCHUK | |
| SCHEMBL4766029 | 0.90 | ACACB (0.54) | ACACBACACACYP2C9 | |
| SCHEMBL3498667 | 0.89 | ACACB (0.43) | ACACBACACACYP2C9IKBKBCHUK | |
| SCHEMBL13312722 | 0.88 | ACACB (0.44) | ACACBACACACYP2C9IKBKBCHUK | |
| SCHEMBL3497216 | 0.87 | ACACB (0.44) | ACACBACACACYP2C9IKBKBCHUK | |
| SCHEMBL3499029 | 0.84 | CYP2C9 (0.39) | ACACBACACACYP2C9IKBKBCHUK |
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 |
|---|---|---|---|---|---|---|---|
| EP-1911753-A1 | SPIRO-CYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2008-04-16 | — | — | EP | disclosed |