Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 1/20 | 0.40 |
| ▸ | F7 | P08709 | 14/20 | 0.37 |
| ▸ | F3 | P13726 | 14/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.37 |
| ▸ | INSR | P06213 | 1/20 | 0.35 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL13613443 | 1.00 | CDK1 (0.40) | CDK1F7F3ALDH1A1CHRNB2 | |
| SCHEMBL13613444 | 1.00 | CDK1 (0.40) | CDK1F7F3ALDH1A1CHRNB2 | |
| Trifluoroacetic Acid SCHEMBL2914337 | 0.94 | F7 (0.36) | CDK1F7F3ALDH1A1CHRNB2 | |
| Trifluoroacetic Acid SCHEMBL2914335 | 0.94 | F7 (0.36) | CDK1F7F3ALDH1A1CHRNB2 | |
| SCHEMBL11348081 | 0.92 | F7 (0.43) | F7F3 | |
| SCHEMBL13613521 | 0.92 | F7 (0.43) | F7F3 | |
| SCHEMBL2914356 | 0.88 | F7 (0.34) | CDK1F7F3ALDH1A1CHRNB2 | |
| Trifluoroacetic Acid SCHEMBL2914351 | 0.84 | F7 (0.37) | CDK1F7F3ALDH1A1CHRNB2 | |
| SCHEMBL13613432 | 0.84 | SLC6A3 (0.35) | F7F3ALK | |
| Hydrochloric Acid SCHEMBL2912239 | 0.83 | SLC6A3 (0.35) | F7F3ALK |
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-7622585-B2 | Phenylglycinamide derivatives useful as anticoagulants | BRISTOL-MYERS SQUIBB COMPANY (US) | 2009-11-24 | — | — | US | disclosed |