Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 7/20 | 0.40 |
| ▸ | MAOA | P21397 | 2/20 | 0.40 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.36 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | GRM5 | P41594 | 10/20 | 0.35 |
| ▸ | VHL | P40337 | 1/20 | 0.33 |
| ▸ | ELOC | Q15369 | 1/20 | 0.33 |
| ▸ | ELOB | Q15370 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.32 |
| ▸ | RELA | Q04206 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | TYMS | P04818 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1694255 | 0.82 | MAOB (0.42) | MAOBMAOALTB4RLTB4R2LMNA | |
| SCHEMBL7761381 | 0.82 | TDP2 (0.44) | MAOBMAOALTB4RLTB4R2LMNA | |
| SCHEMBL20554838 | 0.79 | MAOB (0.47) | MAOBMAOALTB4RLTB4R2LMNA | |
| SCHEMBL8593147 | 0.79 | LMNA (0.42) | MAOBMAOALTB4RLTB4R2LMNA | |
| SCHEMBL12316648 | 0.79 | MAPT (0.45) | MAOBMAOALTB4RLTB4R2LMNA | |
| SCHEMBL25166445 | 0.79 | MAOB (0.40) | MAOBMAOALTB4RLTB4R2LMNA | |
| SCHEMBL10158593 | 0.79 | LMNA (0.52) | MAOBMAOALTB4RLTB4R2LMNA | |
| SCHEMBL6582453 | 0.76 | SIRT2 (0.38) | MAOBMAOALMNAMAPTGRM5 | |
| SCHEMBL13506226 | 0.76 | MAOB (0.37) | MAOBMAOALTB4RLTB4R2GRM5 | |
| SCHEMBL19744350 | 0.75 | MAPT (0.43) | MAOBMAOALMNAMAPTGRM5 |
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-2429993-B1 | INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION | BOEHRINGER INGELHEIM INT (DE) | 2015-01-21 | — | — | EP | disclosed |