Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 5/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | MMP12 | P39900 | 1/20 | 0.49 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 2/20 | 0.46 |
| ▸ | DRD4 | P21917 | 2/20 | 0.46 |
| ▸ | DRD3 | P35462 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4286655 | 0.82 | PARP1 (0.67) | PARP1ALDH1A1MAPTPKMMMP12 | |
| SCHEMBL16421393 | 0.81 | PARP1 (0.65) | PARP1ALDH1A1MAPTPKMMMP12 | |
| SCHEMBL4295364 | 0.81 | PARP1 (0.65) | PARP1ALDH1A1MAPTPKMMMP12 | |
| SCHEMBL10923540 | 0.81 | PARP1 (0.69) | PARP1ALDH1A1MAPTPKMMMP12 | |
| SCHEMBL3087984 | 0.78 | PARP1 (0.64) | PARP1ALDH1A1MAPTPKMMMP12 | |
| SCHEMBL9130576 | 0.78 | PARP1 (0.60) | PARP1ALDH1A1MAPTPKMMMP12 | |
| SCHEMBL554735 | 0.78 | PARP1 (0.72) | PARP1ALDH1A1MAPTPKMMMP12 | |
| SCHEMBL30683552 | 0.78 | PARP1 (0.56) | PARP1ALDH1A1MAPTPKMMMP12 | |
| SCHEMBL11002313 | 0.77 | PARP1 (0.77) | PARP1ALDH1A1MAPTMMP12NR3C2 | |
| SCHEMBL14073116 | 0.77 | PARP1 (0.62) | PARP1ALDH1A1MAPTMMP12NR3C2 |
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-1971596-A2 | FUSED HETEROCYCLIC COMPOUNDS AND THEIR USE AS MINERALOCORTICOID RECEPTOR LIGANDS | Takeda Pharmaceutical Company Limited (JP) | 2008-09-24 | — | — | EP | disclosed |
| WO-2007077961-A2 | FUSED HETEROCYCLIC COMPOUNDS AND THEIR USE AS MINERALOCORTICOID RECEPTOR LIGANDS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-07-12 | — | — | WO | disclosed |