Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IL4I1 | Q96RQ9 | 1/20 | 0.44 |
| ▸ | NR3C1 | P04150 | 3/20 | 0.43 |
| ▸ | PGR | P06401 | 3/20 | 0.43 |
| ▸ | NR3C2 | P08235 | 3/20 | 0.43 |
| ▸ | MMP12 | P39900 | 1/20 | 0.39 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.39 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.34 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL5340556 | 0.80 | IL4I1 (0.43) | IL4I1NR3C1PGRNR3C2MMP12 | |
| SCHEMBL4290482 | 0.79 | IL4I1 (0.44) | IL4I1NR3C1PGRNR3C2MMP12 | |
| SCHEMBL3600619 | 0.79 | IL4I1 (0.44) | IL4I1NR3C1PGRNR3C2MMP12 | |
| SCHEMBL20278370 | 0.79 | PDE3B (0.55) | IL4I1NR3C1PGRNR3C2MMP12 | |
| SCHEMBL8489457 | 0.76 | NR3C2 (0.44) | IL4I1NR3C1PGRNR3C2MMP12 | |
| SCHEMBL4291175 | 0.74 | ALDH1A1 (0.45) | IL4I1NR3C1PGRNR3C2MMP12 | |
| SCHEMBL20265314 | 0.74 | ALDH1A1 (0.44) | IL4I1NR3C1PGRNR3C2MMP12 | |
| SCHEMBL4261663 | 0.74 | IL4I1 (0.45) | IL4I1NR3C1PGRNR3C2MMP12 | |
| SCHEMBL31170719 | 0.74 | IL4I1 (0.45) | IL4I1NR3C1PGRNR3C2MMP12 | |
| SCHEMBL4100769 | 0.73 | MMP12 (0.44) | IL4I1NR3C1PGRNR3C2MMP12 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007077961-A2 | FUSED HETEROCYCLIC COMPOUNDS AND THEIR USE AS MINERALOCORTICOID RECEPTOR LIGANDS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-07-12 | — | — | WO | disclosed |