Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.47 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CCR2 | P41597 | 4/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.34 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2600855 | 0.87 | SIRT1 (0.46) | SIRT1PI4KBSMN1; SMN2KMT2ACCR2 | |
| SCHEMBL2600851 | 0.87 | SIRT1 (0.46) | SIRT1PI4KBSMN1; SMN2KMT2ACCR2 | |
| SCHEMBL9071272 | 0.76 | SIRT1 (0.49) | SIRT1PI4KBSMN1; SMN2KMT2ACCR2 | |
| SCHEMBL2600845 | 0.75 | SIRT1 (0.49) | SIRT1PI4KBSMN1; SMN2KMT2ACCR2 | |
| SCHEMBL1742461 | 0.75 | PTPRB (0.49) | SIRT1PI4KBSMN1; SMN2KMT2ACCR2 | |
| SCHEMBL2175797 | 0.74 | SMN1; SMN2 (0.50) | SIRT1PI4KBSMN1; SMN2KMT2ACCR2 | |
| SCHEMBL1030124 | 0.74 | PI4KB (0.50) | SIRT1PI4KBSMN1; SMN2KMT2ACCR2 | |
| SCHEMBL2600847 | 0.74 | SIRT1 (0.46) | SIRT1PI4KBSMN1; SMN2KMT2ACCR2 | |
| SCHEMBL2600849 | 0.74 | SIRT1 (0.46) | SIRT1PI4KBSMN1; SMN2KMT2ACCR2 | |
| SCHEMBL7419507 | 0.74 | SMN1; SMN2 (0.56) | SIRT1SMN1; SMN2KMT2ATSHRMAPK1 |
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-2008042353-A1 | POTENT AND HIGHLY SELECTIVE HETEROAROMATIC INHIBITORS OF NEURONAL NITRIC OXIDE SYNTHASE | NORTHWESTERN UNIVERSITY (US) | 2008-04-10 | — | — | WO | disclosed |