Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 1/20 | 0.39 |
| ▸ | ACACA | Q13085 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.39 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.39 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6496338 | 1.00 | ACACB (0.39) | ACACBACACANOS2ALKNPC1 | |
| SCHEMBL6270039 | 0.92 | ACACB (0.41) | ACACBACACAALKROCK2TDP1 | |
| SCHEMBL6270040 | 0.92 | ACACB (0.41) | ACACBACACAALKROCK2TDP1 | |
| SCHEMBL6203797 | 0.92 | ACACB (0.41) | ACACBACACAALKROCK2TDP1 | |
| SCHEMBL6270035 | 0.92 | ACACB (0.41) | ACACBACACAALKROCK2TDP1 | |
| SCHEMBL6202727 | 0.90 | ACACB (0.41) | ACACBACACAALKPTGER4PTGER2 | |
| SCHEMBL6202729 | 0.90 | ACACB (0.41) | ACACBACACAALKPTGER4PTGER2 | |
| SCHEMBL6202724 | 0.90 | ACACB (0.41) | ACACBACACAALKPTGER4PTGER2 | |
| SCHEMBL6502173 | 0.90 | GAA (0.42) | PTGER4PTGER2ROCK2 | |
| SCHEMBL6502171 | 0.90 | GAA (0.42) | PTGER4PTGER2ROCK2 |
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-6900210-B2 | Pyridinyl, pyrimidinyl and pyrazinyl amides as potassium channel openers | BRISTOL-MYERS SQUIBB COMPANY (US) | 2005-05-31 | — | — | US | disclosed |