Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 8/20 | 0.53 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | UGT8 | Q16880 | 3/20 | 0.41 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.40 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.40 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.40 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22236812 | 0.92 | CYP11B2 (0.51) | CYP11B2CYP11B1ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL18790969 | 0.81 | CYP11B2 (0.52) | CYP11B2CYP11B1ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL18790702 | 0.81 | CYP11B2 (0.52) | CYP11B2CYP11B1ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL18791093 | 0.76 | CYP11B2 (0.66) | CYP11B2CYP11B1ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL18791021 | 0.76 | CYP11B2 (0.69) | CYP11B2CYP11B1ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL18790691 | 0.75 | CYP11B2 (0.54) | CYP11B2CYP11B1ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL18791007 | 0.74 | ALDH1A1 (0.46) | CYP11B2CYP11B1ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL18790700 | 0.73 | CYP11B2 (0.56) | CYP11B2CYP11B1ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL25058189 | 0.72 | CHRM3 (0.44) | ALDH1A1KDM4ESMN1; SMN2TDP1CHRM3 | |
| SCHEMBL20340176 | 0.71 | CYP11B2 (0.77) | CYP11B2CYP11B1 |
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-3381904-B1 | NOVEL NITROGEN-CONTAINING AROMATIC HETEROCYCLIC COMPOUND | MITSUBISHI TANABE PHARMA CORP (JP) | 2021-07-28 | — | — | EP | disclosed |