Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ROCK1 | Q13464 | 9/20 | 0.45 |
| ▸ | ROCK2 | O75116 | 6/20 | 0.45 |
| ▸ | PRKG1 | Q13976 | 5/20 | 0.45 |
| ▸ | PRKACA | P17612 | 5/20 | 0.45 |
| ▸ | GSK3A | P49840 | 5/20 | 0.45 |
| ▸ | GSK3B | P49841 | 5/20 | 0.45 |
| ▸ | PRKX | P51817 | 5/20 | 0.45 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.45 |
| ▸ | RPS6KA5 | O75582 | 3/20 | 0.45 |
| ▸ | RPS6KB1 | P23443 | 3/20 | 0.45 |
| ▸ | CDK2 | P24941 | 3/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.45 |
| ▸ | AKT2 | P31751 | 3/20 | 0.45 |
| ▸ | PRKCD | Q05655 | 3/20 | 0.45 |
| ▸ | PRKG2 | Q13237 | 3/20 | 0.45 |
| ▸ | PKN2 | Q16513 | 3/20 | 0.45 |
| ▸ | CDC42BPA | Q5VT25 | 3/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6486435 | 1.00 | TDP1 (0.50) | TDP1LMNAKDM4EROCK1ROCK2 | |
| SCHEMBL6486441 | 1.00 | TDP1 (0.50) | TDP1LMNAKDM4EROCK1ROCK2 | |
| SCHEMBL6502176 | 0.92 | TDP1 (0.62) | TDP1LMNAROCK1ROCK2PRKG1 | |
| SCHEMBL6502179 | 0.92 | TDP1 (0.62) | TDP1LMNAROCK1ROCK2PRKG1 | |
| SCHEMBL6203531 | 0.91 | TDP1 (0.49) | TDP1LMNAROCK1ROCK2PRKG1 | |
| SCHEMBL6488900 | 0.91 | TDP1 (0.49) | TDP1LMNAROCK1ROCK2PRKG1 | |
| SCHEMBL6488897 | 0.91 | TDP1 (0.49) | TDP1LMNAROCK1ROCK2PRKG1 | |
| SCHEMBL6488892 | 0.91 | TDP1 (0.49) | TDP1LMNAROCK1ROCK2PRKG1 | |
| SCHEMBL6203536 | 0.91 | TDP1 (0.49) | TDP1LMNAROCK1ROCK2PRKG1 | |
| SCHEMBL6203533 | 0.91 | TDP1 (0.49) | TDP1LMNAROCK1ROCK2PRKG1 |
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 |