Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.35 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8774132 | 0.95 | NPC1 (0.40) | TAAR1L3MBTL1TP53NPC1PKM | |
| SCHEMBL8775147 | 0.89 | NPC1 (0.47) | TP53NPC1PKMRAB9ASMN1; SMN2 | |
| SCHEMBL8774481 | 0.86 | NFKB1 (0.44) | L3MBTL1TP53NPC1PKMRAB9A | |
| SCHEMBL8774337 | 0.85 | RAB9A (0.50) | TAAR1L3MBTL1TP53NPC1PKM | |
| SCHEMBL12188705 | 0.85 | RXRA (0.33) | L3MBTL1TP53NPC1PKMRAB9A | |
| SCHEMBL8774239 | 0.83 | HTR2A (0.50) | L3MBTL1TP53NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL8774669 | 0.83 | NQO1 (0.44) | L3MBTL1TP53RAB9ASMN1; SMN2GPR84 | |
| SCHEMBL8774784 | 0.82 | RAB9A (0.46) | L3MBTL1TP53NPC1PKMRAB9A | |
| SCHEMBL8774178 | 0.81 | CYP3A4 (0.43) | L3MBTL1NPC1PKMRAB9ASMN1; SMN2 | |
| SCHEMBL8774716 | 0.81 | LMNA (0.47) | L3MBTL1NPC1RAB9ASMN1; SMN2HSD17B10 |
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 |