Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.42 |
| ▸ | MAP3K7 | O43318 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 2/20 | 0.36 |
| ▸ | JAK1 | P23458 | 2/20 | 0.36 |
| ▸ | TYK2 | P29597 | 2/20 | 0.36 |
| ▸ | JAK3 | P52333 | 2/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP8 | P22894 | 1/20 | 0.35 |
| ▸ | MMP12 | P39900 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.35 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.35 |
| ▸ | BMPR1A | P36894 | 1/20 | 0.35 |
| ▸ | ACVRL1 | P37023 | 1/20 | 0.35 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 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 | |
|---|---|---|---|---|
| SCHEMBL875170 | 0.82 | HDAC1 (0.41) | MAP3K7JAK2JAK1TYK2JAK3 | |
| SCHEMBL10069158 | 0.80 | CD274 (0.41) | CD274USP2SCN9AACVR1HDAC2 | |
| SCHEMBL874666 | 0.76 | IKBKB (0.55) | SMN1; SMN2JAK2JAK1TYK2JAK3 | |
| SCHEMBL10070169 | 0.73 | NAMPT (0.36) | CD274MAP3K7JAK2JAK1TYK2 | |
| SCHEMBL875205 | 0.73 | PTPN1 (0.51) | SMN1; SMN2ALDH1A1KMT2AMAPTHSD17B10 | |
| SCHEMBL875381 | 0.72 | NAMPT (0.47) | JAK2JAK1TYK2JAK3KMT2A | |
| SCHEMBL882720 | 0.71 | KDM4E (0.53) | SMN1; SMN2ALDH1A1KMT2AMAPTHSD17B10 | |
| SCHEMBL882758 | 0.67 | CD274 (0.37) | CD274SCN9AALDH1A1TSHRCYP1A2 | |
| SCHEMBL28735456 | 0.64 | MEN1 (0.49) | CD274TGFBR1HDAC2HDAC8HDAC6 | |
| SCHEMBL13071736 | 0.63 | CHRNB2 (0.57) | CD274SCN9AHDAC2HDAC8HDAC6 |
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-2012038904-A1 | NICOTINAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF | SANOFI (FR) | 2012-03-29 | — | — | WO | disclosed |