Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 13/20 | 0.62 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.62 |
| ▸ | MAOA | P21397 | 2/20 | 0.57 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.55 |
| ▸ | GRM5 | P41594 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.55 |
| ▸ | RELA | Q04206 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL23905817 | 0.83 | BRD4 (0.67) | MAOBMAOANPC1ALDH1A1HPGD | |
| SCHEMBL1823533 | 0.82 | AR (0.69) | MAOBCYP19A1MAOAPSMB5NPC1 | |
| SCHEMBL23906288 | 0.81 | BRD4 (0.53) | MAOBCYP19A1MAOANPC1ALDH1A1 | |
| SCHEMBL23905844 | 0.79 | CYP19A1 (0.63) | MAOBCYP19A1MAOANPC1ALDH1A1 | |
| SCHEMBL9749301 | 0.78 | MAOB (0.67) | MAOBCYP19A1MAOANPC1ALDH1A1 | |
| SCHEMBL11290060 | 0.77 | MAOB (0.65) | MAOBCYP19A1MAOAPSMB5CYP3A4 | |
| SCHEMBL6171810 | 0.77 | MAOB (0.55) | MAOBCYP19A1MAOAPSMB5CYP3A4 | |
| SCHEMBL1895399 | 0.77 | MAOB (1.00) | MAOBCYP19A1NPC1RAB9ACYP3A4 | |
| SCHEMBL131515 | 0.77 | MAOB (1.00) | MAOBCYP19A1NPC1RAB9ACYP3A4 | |
| SCHEMBL23905149 | 0.76 | MAOB (0.77) | MAOBMAOANPC1ALDH1A1HPGD |
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-2021198283-A1 | INHIBITORS OF ANTIGEN PRESENTATION BY HLA-DR | JANSSEN PHARMACEUTICA NV (BE) | 2021-10-07 | — | — | WO | disclosed |