Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 9/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.32 |
| ▸ | DHODH | Q02127 | 1/20 | 0.32 |
| ▸ | KMO | O15229 | 2/20 | 0.32 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 2/20 | 0.31 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.31 |
| ▸ | AKT1 | P31749 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9313464 | 1.00 | KDM1A (0.35) | KDM1ACYP11B1CYP11B2NPC1TP53 | |
| SCHEMBL8381559 | 1.00 | KDM1A (0.35) | KDM1ACYP11B1CYP11B2NPC1TP53 | |
| SCHEMBL8381561 | 1.00 | KDM1A (0.35) | KDM1ACYP11B1CYP11B2NPC1TP53 | |
| SCHEMBL9313784 | 0.92 | KDM1A (0.36) | KDM1ACYP11B1CYP11B2NPC1TP53 | |
| SCHEMBL9313788 | 0.92 | KDM1A (0.36) | KDM1ACYP11B1CYP11B2NPC1TP53 | |
| SCHEMBL8383727 | 0.92 | KDM1A (0.36) | KDM1ACYP11B1CYP11B2NPC1TP53 | |
| SCHEMBL9313837 | 0.91 | KDM1A (0.39) | KDM1ACYP11B1CYP11B2NPC1TP53 | |
| SCHEMBL8381998 | 0.91 | KDM1A (0.39) | KDM1ACYP11B1CYP11B2NPC1TP53 | |
| SCHEMBL8382002 | 0.91 | KDM1A (0.39) | KDM1ACYP11B1CYP11B2NPC1TP53 | |
| SCHEMBL9718521 | 0.89 | CYP11B1 (0.35) | CYP11B1CYP11B2DHODHGPR139RPS6KB1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5292452-A | Electrooptical devices; high dielectric anisotropy, low rotation viscosity, short response time | HOFFMANN-LA ROCHE INC. (US) | 1994-03-08 | — | — | US | disclosed |