Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 6/20 | 0.37 |
| ▸ | CA2 | P00918 | 6/20 | 0.37 |
| ▸ | CA7 | P43166 | 2/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | AKT1 | P31749 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 6/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.35 |
| ▸ | APLNR | P35414 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 4/20 | 0.35 |
| ▸ | CTSK | P43235 | 2/20 | 0.33 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5493643 | 0.85 | TDP1 (0.41) | TDP1CA1CA2CA7MAOA | |
| SCHEMBL13357351 | 0.83 | TDP1 (0.40) | TDP1CA1CA2CA7MAOA | |
| SCHEMBL12142875 | 0.82 | TDP1 (0.39) | TDP1CA1CA2CA7MAOA | |
| SCHEMBL3709339 | 0.82 | TDP1 (0.47) | TDP1CA1CA2CA7MAOA | |
| SCHEMBL5494091 | 0.82 | APLNR (0.40) | TDP1CA1CA2CA7MAOA | |
| SCHEMBL20464123 | 0.82 | CA1 (0.43) | TDP1CA1CA2CA7MAOA | |
| SCHEMBL13744650 | 0.80 | CA12 (0.39) | TDP1CA1CA2CA7MAOA | |
| SCHEMBL20880909 | 0.80 | TDP1 (0.38) | TDP1CA1CA2CA7MAOA | |
| SCHEMBL1039597 | 0.80 | TDP1 (0.38) | TDP1CA1CA2CA7MAOA | |
| Hydrochloric Acid SCHEMBL20450582 | 0.80 | TDP1 (0.38) | TDP1CA1CA2CA7MAOA |
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 |