Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 14/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.47 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | FAAH | O00519 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2548412 | 1.00 | NAMPT (0.56) | NAMPTCYP3A4CYP2C9HDAC3HDAC4 | |
| SCHEMBL19834789 | 0.99 | NAMPT (0.56) | NAMPTCYP3A4CYP2C9HDAC3HDAC4 | |
| SCHEMBL25270490 | 0.94 | NAMPT (0.50) | NAMPTCYP3A4CYP2C9HDAC3HDAC4 | |
| SCHEMBL25642275 | 0.94 | NAMPT (0.50) | NAMPTCYP3A4CYP2C9HDAC3HDAC4 | |
| SCHEMBL25261307 | 0.94 | NAMPT (0.50) | NAMPTCYP3A4CYP2C9HDAC3HDAC4 | |
| SCHEMBL25642158 | 0.94 | NAMPT (0.50) | NAMPTCYP3A4CYP2C9HDAC3HDAC4 | |
| SCHEMBL20095460 | 0.90 | NAMPT (0.46) | NAMPTCYP3A4CYP2C9HDAC3HDAC4 | |
| SCHEMBL19834836 | 0.90 | NAMPT (0.58) | NAMPTCYP3A4CYP2C9HDAC3HDAC4 | |
| SCHEMBL27008644 | 0.89 | NAMPT (0.47) | NAMPTCYP3A4CYP2C9 | |
| SCHEMBL19834855 | 0.87 | PABPC1 (0.46) | NAMPTCYP3A4CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011121055-A1 | PYRIDINYL DERIVATIVES COMPRISING A CYANOGUANIDINE OR SQUARIC ACID MOIETY | TOPOTARGET A/S (DK) | 2011-10-06 | — | — | WO | claimed |