Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | LPL | P06858 | 1/20 | 0.36 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | GFER | P55789 | 1/20 | 0.35 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.35 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8774337 | 0.95 | RAB9A (0.50) | NPC1RAB9ATP53SMN1; SMN2PKM | |
| SCHEMBL8774481 | 0.90 | NFKB1 (0.44) | NPC1RAB9ATP53SMN1; SMN2PKM | |
| SCHEMBL8774752 | 0.89 | TAAR1 (0.44) | NPC1RAB9ATP53SMN1; SMN2PKM | |
| SCHEMBL8774239 | 0.87 | HTR2A (0.50) | NPC1RAB9ATP53SMN1; SMN2HSD17B10 | |
| SCHEMBL8774784 | 0.85 | RAB9A (0.46) | NPC1RAB9ATP53SMN1; SMN2PKM | |
| SCHEMBL8774132 | 0.85 | NPC1 (0.40) | NPC1RAB9ATP53SMN1; SMN2PKM | |
| SCHEMBL8774178 | 0.84 | CYP3A4 (0.43) | NPC1RAB9ASMN1; SMN2PKMHSD17B10 | |
| SCHEMBL8774406 | 0.84 | RARB (0.50) | NPC1RAB9ASMN1; SMN2HSD17B10MAPT | |
| SCHEMBL8774716 | 0.84 | LMNA (0.47) | NPC1RAB9ASMN1; SMN2HSD17B10MAPT | |
| SCHEMBL8774669 | 0.83 | NQO1 (0.44) | RAB9ATP53SMN1; SMN2MAPTPDGFRB |
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 |