Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.40 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.40 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.40 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.40 |
| ▸ | SYK | P43405 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | DHFR | P00374 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8774178 | 0.88 | CYP3A4 (0.43) | MAPTRAB9AL3MBTL1ALDH1A1LMNA | |
| SCHEMBL8774716 | 0.88 | LMNA (0.47) | MAPTRAB9AL3MBTL1ALDH1A1POLB | |
| SCHEMBL8774858 | 0.85 | MEN1 (0.44) | MAPTRAB9AL3MBTL1ALDH1A1LMNA | |
| SCHEMBL8775147 | 0.83 | NPC1 (0.47) | MAPTRAB9AGPR84TP53PDGFRB | |
| SCHEMBL8774752 | 0.83 | TAAR1 (0.44) | RAB9AL3MBTL1GPR84ALDH1A1TP53 | |
| SCHEMBL8774481 | 0.81 | NFKB1 (0.44) | MAPTRAB9AL3MBTL1TDP1ALDH1A1 | |
| SCHEMBL8110627 | 0.80 | NQO1 (0.50) | NQO1GPR84TDP1SLC5A1SLC5A2 | |
| SCHEMBL8774132 | 0.79 | NPC1 (0.40) | RAB9AL3MBTL1GPR84TP53PDGFRB | |
| SCHEMBL8774337 | 0.79 | RAB9A (0.50) | MAPTRAB9AL3MBTL1ALDH1A1TP53 | |
| SCHEMBL8774796 | 0.79 | NQO1 (0.41) | NQO1GPR84TDP1ALDH1A1TP53 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0519370-B1 | Heterocyclic derivatives | MERCK PATENT GMBH (DE) | 1997-11-05 | — | — | EP | disclosed |
| EP-0519370-A2 | Heterocyclic derivatives | MERCK PATENT GmbH (DE) | 1992-12-23 | — | — | EP | disclosed |