Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKCI | P41743 | 3/20 | 0.44 |
| ▸ | AKT2 | P31751 | 2/20 | 0.37 |
| ▸ | AXL | P30530 | 1/20 | 0.37 |
| ▸ | ATR | Q13535 | 1/20 | 0.35 |
| ▸ | ATRIP | Q8WXE1 | 1/20 | 0.35 |
| ▸ | NUDT1 | P36639 | 6/20 | 0.35 |
| ▸ | AURKA | O14965 | 1/20 | 0.34 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.34 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.34 |
| ▸ | TPX2 | Q9ULW0 | 1/20 | 0.34 |
| ▸ | PBK | Q96KB5 | 2/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.34 |
| ▸ | CCNK | O75909 | 2/20 | 0.34 |
| ▸ | CDK12 | Q9NYV4 | 2/20 | 0.34 |
| ▸ | JAK3 | P52333 | 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 | |
|---|---|---|---|---|
| SCHEMBL28046320 | 0.85 | PRKCI (0.57) | PRKCIAKT2AXLNUDT1AURKA | |
| Tert-Butyl Formate SCHEMBL28046344 | 0.81 | PRKCI (0.43) | PRKCIAKT2AXLATRATRIP | |
| Tert-Butyl Formate SCHEMBL28092266 | 0.76 | AKT2 (0.51) | AKT2NUDT1PBK | |
| Tert-Butyl Formate SCHEMBL28801384 | 0.75 | KDM4E (0.31) | — | |
| Tert-Butyl Formate SCHEMBL27870995 | 0.74 | PRKCI (0.66) | PRKCIAXLNUDT1AURKAAURKB | |
| Tert-Butyl Formate SCHEMBL27893619 | 0.66 | AXL (0.64) | AXLNUDT1AURKBJAK3 | |
| SCHEMBL21975051 | 0.65 | PRKCI (0.49) | PRKCIAKT2AXLNUDT1AURKA | |
| SCHEMBL4934159 | 0.65 | JAK1 (0.53) | AKT2NUDT1PBKJAK3 | |
| SCHEMBL13774670 | 0.65 | PRKCI (0.70) | PRKCIAKT2AXLNUDT1AURKA | |
| SCHEMBL27741956 | 0.64 | PRKCI (0.65) | PRKCIAKT2AXLNUDT1AURKA |
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 |
|---|---|---|---|---|---|---|---|
| CN-102958918-B | Novel tobacco amide derivatives or its salt | FUJIFILM CORP. (JP) | 2015-12-09 | — | — | CN | disclosed |