Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 10/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | ELANE | P08246 | 5/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | KCNQ3 | O43525 | 2/20 | 0.47 |
| ▸ | KCNQ2 | O43526 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL4542561 | 0.92 | ELANE (0.57) | NAMPTCYP3A4CYP2C9CYP2C19ELANE | |
| SCHEMBL5019840 | 0.85 | KCNQ3 (0.59) | NAMPTCYP3A4CYP2C9CYP2C19ELANE | |
| SCHEMBL15646085 | 0.82 | NAMPT (0.58) | NAMPTCYP3A4CYP2C9CYP2C19ELANE | |
| SCHEMBL15647175 | 0.79 | NAMPT (0.60) | NAMPTCYP3A4CYP2C9CYP2C19ELANE | |
| SCHEMBL15645501 | 0.78 | NAMPT (0.62) | NAMPTELANE | |
| SCHEMBL15645336 | 0.78 | NAMPT (0.57) | NAMPTCYP3A4CYP2C9CYP2C19MAPT | |
| SCHEMBL15646125 | 0.77 | NAMPT (0.55) | NAMPTCYP3A4CYP2C9CYP2C19MAPT | |
| SCHEMBL15646824 | 0.77 | DDR1 (0.53) | ELANEMAPTLMNAKMT2AKCNQ3 | |
| SCHEMBL15648419 | 0.77 | NAMPT (0.65) | NAMPTCYP3A4CYP2C9CYP2C19MAPT | |
| SCHEMBL15645900 | 0.76 | KCNQ3 (0.53) | NAMPTCYP3A4CYP2C9CYP2C19ELANE |
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-2012061926-A1 | BISARYLSULFONE AND DIALKYLARYLSULFONE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS | ZALICUS PHARMACEUTICALS LTD. (CA) | 2012-05-18 | — | — | WO | disclosed |