Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 5/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.41 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.40 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8774724 | 0.90 | AKR1C2 (0.50) | RAB9ASMN1; SMN2NPC1TP53HSD17B10 | |
| SCHEMBL8774115 | 0.89 | RAB9A (0.49) | RAB9ASMN1; SMN2NPC1HSD17B10AKR1C2 | |
| SCHEMBL8774222 | 0.88 | MAPT (0.51) | RAB9ASMN1; SMN2NPC1HSD17B10AKR1C2 | |
| SCHEMBL8774963 | 0.88 | MAPT (0.51) | RAB9ASMN1; SMN2NPC1HSD17B10AKR1C2 | |
| SCHEMBL8774839 | 0.86 | EGLN1 (0.45) | RAB9ASMN1; SMN2NPC1TP53MAP4K4 | |
| SCHEMBL8774671 | 0.85 | NPC1 (0.42) | RAB9ASMN1; SMN2NPC1TP53HSD17B10 | |
| SCHEMBL8774683 | 0.83 | RAB9A (0.40) | RAB9ASMN1; SMN2NPC1TP53HSD17B10 | |
| SCHEMBL8774299 | 0.82 | GPR84 (0.36) | RAB9ASMN1; SMN2NPC1MAP4K4AKR1C2 | |
| SCHEMBL8774303 | 0.82 | GPR84 (0.36) | RAB9ASMN1; SMN2NPC1MAP4K4AKR1C2 | |
| SCHEMBL8774328 | 0.80 | GPR84 (0.38) | RAB9ASMN1; SMN2NPC1HSD17B10MAP4K4 |
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 |