Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALCA | P06881 | 4/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | EGLN1 | Q9GZT9 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.43 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.43 |
| ▸ | FEN1 | P39748 | 1/20 | 0.43 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4072026 | 0.90 | CALCA (0.52) | CALCAKMT2AEGLN1SMN1; SMN2RPS6KB1 | |
| SCHEMBL4071242 | 0.90 | CALCA (0.54) | CALCAKMT2AEGLN1SMN1; SMN2RPS6KB1 | |
| SCHEMBL7258671 | 0.86 | ADORA2A (0.44) | CALCAEGLN1 | |
| SCHEMBL4067905 | 0.86 | KMT2A (0.61) | CALCAKMT2AEGLN1RPS6KB1ERCC1 | |
| SCHEMBL4067912 | 0.86 | KMT2A (0.61) | CALCAKMT2AEGLN1RPS6KB1ERCC1 | |
| SCHEMBL4067907 | 0.85 | CALCA (0.58) | CALCAKMT2AEGLN1SMN1; SMN2RPS6KB1 | |
| SCHEMBL4059927 | 0.85 | CALCA (0.54) | CALCAKMT2AEGLN1SMN1; SMN2RPS6KB1 | |
| SCHEMBL7262168 | 0.85 | ADORA2A (0.43) | CALCAEGLN1 | |
| SCHEMBL6504246 | 0.85 | CALCA (0.60) | CALCAKMT2AEGLN1SMN1; SMN2RPS6KB1 | |
| SCHEMBL6490436 | 0.85 | CALCA (0.62) | CALCAKMT2AEGLN1SMN1; SMN2RPS6KB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1326865-B1 | AZA- AND POLYAZA-NAPHTHALENYL CARBOXAMIDES USEFUL AS HIV INTEGRASE INHIBITORS | MERCK & CO INC (US) | 2009-05-06 | — | — | EP | claimed |