Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | NAMPT | P43490 | 2/20 | 0.45 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.45 |
| ▸ | BCL2 | P10415 | 1/20 | 0.42 |
| ▸ | AKT1 | P31749 | 2/20 | 0.40 |
| ▸ | GLS | O94925 | 2/20 | 0.38 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CDK9 | P50750 | 1/20 | 0.37 |
| ▸ | SCD | O00767 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL540467 | 0.89 | NAMPT (0.49) | HDAC1NAMPTGRIN2BBCL2AKT1 | |
| SCHEMBL7382657 | 0.81 | NR4A1 (0.39) | HDAC1NAMPTGRIN2BAKT1CDK9 | |
| SCHEMBL16296315 | 0.79 | NAMPT (0.48) | HDAC1NAMPTGRIN2BBCL2AKT1 | |
| SCHEMBL949620 | 0.78 | NAMPT (0.48) | HDAC1NAMPTGRIN2BBCL2GLS | |
| SCHEMBL540536 | 0.78 | NAMPT (0.50) | HDAC1NAMPTGRIN2BBCL2CYP17A1 | |
| SCHEMBL15354526 | 0.78 | NAMPT (0.50) | HDAC1NAMPTGRIN2BBCL2CYP17A1 | |
| SCHEMBL27690459 | 0.77 | GAA (0.45) | HDAC1NAMPTGRIN2BBCL2AKT1 | |
| SCHEMBL29523504 | 0.76 | HDAC1 (0.52) | HDAC1NAMPTGRIN2BBCL2CYP17A1 | |
| SCHEMBL9980800 | 0.76 | NAMPT (0.49) | HDAC1NAMPTGRIN2BBCL2CYP17A1 | |
| SCHEMBL164105 | 0.76 | HDAC1 (0.52) | HDAC1NAMPTGRIN2BBCL2CYP17A1 |
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-1180098-A1 | NEW COMPOUNDS | AstraZeneca AB (SE) | 2002-02-20 | — | — | EP | disclosed |
| WO-2000066557-A1 | NEW COMPOUNDS | ASTRAZENECA AB (SE) | 2000-11-09 | — | — | WO | disclosed |