Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.64 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.58 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.56 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.56 |
| ▸ | MAOB | P27338 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 4/20 | 0.50 |
| ▸ | TP53 | P04637 | 3/20 | 0.50 |
| ▸ | MAOA | P21397 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.49 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | MMP1 | P03956 | 2/20 | 0.47 |
| ▸ | MMP2 | P08253 | 2/20 | 0.47 |
| ▸ | MMP9 | P14780 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL20585389 | 0.88 | HSD11B1 (0.64) | HSD11B1TNFRSF1ACYP1A1CYP1B1MAOB | |
| SCHEMBL7625602 | 0.84 | TYR (0.61) | HSD11B1CYP1A1CYP1B1MAOBCYP1A2 | |
| SCHEMBL7625595 | 0.84 | TYR (0.61) | HSD11B1CYP1A1CYP1B1MAOBCYP1A2 | |
| SCHEMBL6851216 | 0.82 | HSD11B1 (0.62) | HSD11B1TNFRSF1ACYP1A1CYP1B1MAOB | |
| SCHEMBL5150867 | 0.82 | CYP1A2 (0.62) | CYP1B1MAOBLMNATP53MAOA | |
| SCHEMBL8878144 | 0.82 | HSD11B1 (0.62) | HSD11B1TNFRSF1ACYP1A1CYP1B1MAOB | |
| SCHEMBL5856758 | 0.82 | CYP1B1 (0.57) | CYP1A1CYP1B1MAOBMAOAALDH1A1 | |
| SCHEMBL5856754 | 0.82 | CYP1B1 (0.57) | CYP1A1CYP1B1MAOBMAOAALDH1A1 | |
| SCHEMBL5150869 | 0.82 | CYP1A2 (0.62) | CYP1B1MAOBLMNATP53MAOA | |
| SCHEMBL2396441 | 0.82 | LMNA (0.59) | TNFRSF1ACYP1A1CYP1B1MAOBLMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-1681763-A | Chemical compounds | ASTRAZENECA AB (SE) | 2005-10-12 | — | — | CN | disclosed |