Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 9/20 | 0.49 |
| ▸ | NPC1 | O15118 | 8/20 | 0.49 |
| ▸ | TP53 | P04637 | 7/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | HSP90B1 | P14625 | 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 | |
|---|---|---|---|---|
| SCHEMBL9369101 | 0.78 | RAB9A (0.54) | RAB9ANPC1TP53LMNAMAPT | |
| SCHEMBL9369115 | 0.78 | HSP90AA1 (0.37) | TP53LMNAKMT2AHSP90AA1HSP90B1 | |
| SCHEMBL9369394 | 0.76 | MEN1 (0.32) | TP53KMT2A | |
| SCHEMBL9369020 | 0.75 | ADORA2B (0.33) | MAPT | |
| SCHEMBL9368824 | 0.73 | — | — | |
| SCHEMBL9369816 | 0.72 | HSP90AA1 (0.37) | TP53LMNAKMT2AHSP90AA1HSP90B1 | |
| SCHEMBL9368817 | 0.71 | — | — | |
| SCHEMBL10775575 | 0.70 | NOS2 (0.33) | LMNAKMT2A | |
| SCHEMBL10616909 | 0.69 | NPC1 (0.44) | RAB9ANPC1TP53LMNAKMT2A | |
| SCHEMBL9368527 | 0.68 | — | — |
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-0244803-B1 | Novel dopamine beta hydroxylase inhibitors | MERRELL DOW PHARMA (US) | 1994-10-26 | — | — | EP | disclosed |
| EP-0244803-A2 | Novel dopamine beta hydroxylase inhibitors | MERRELL DOW PHARMACEUTICALS INC. (US) | 1987-11-11 | — | — | EP | disclosed |