Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 4/20 | 0.41 |
| ▸ | NAMPT | P43490 | 7/20 | 0.40 |
| ▸ | KIT | P10721 | 1/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.38 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.38 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | IKBKB | O14920 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | JAK1 | P23458 | 1/20 | 0.34 |
| ▸ | TYK2 | P29597 | 1/20 | 0.34 |
| ▸ | JAK3 | P52333 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL875381 | 0.92 | NAMPT (0.47) | HDAC1NAMPTKITJAK2JAK1 | |
| SCHEMBL875967 | 0.87 | NAMPT (0.40) | HDAC1NAMPTKITROCK2LIMK1 | |
| SCHEMBL10070169 | 0.86 | NAMPT (0.36) | HDAC1NAMPTLIMK1MAP3K7RXFP1 | |
| SCHEMBL874891 | 0.83 | HDAC1 (0.50) | HDAC1NAMPTROCK2IKBKB | |
| SCHEMBL875667 | 0.82 | CD274 (0.42) | MAP3K7JAK2JAK1TYK2JAK3 | |
| SCHEMBL3051319 | 0.81 | NAMPT (0.40) | HDAC1NAMPTKITROCK2JAK2 | |
| SCHEMBL875067 | 0.81 | NAMPT (0.44) | HDAC1NAMPT | |
| SCHEMBL875016 | 0.80 | NAMPT (0.41) | HDAC1NAMPTKITROCK2CNR1 | |
| SCHEMBL874755 | 0.79 | NAMPT (0.47) | HDAC1NAMPTKIT | |
| SCHEMBL486122 | 0.75 | PIK3CA (0.39) | HDAC1KIT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012038904-A1 | NICOTINAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF | SANOFI (FR) | 2012-03-29 | — | — | WO | disclosed |
| WO-2012038904-A1 | NICOTINAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF | SANOFI (FR) | 2012-03-29 | — | — | WO | disclosed |