Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | SYK | P43405 | 5/20 | 0.51 |
| ▸ | KDR | P35968 | 3/20 | 0.51 |
| ▸ | DAPK3 | O43293 | 2/20 | 0.51 |
| ▸ | PRKD3 | O94806 | 2/20 | 0.51 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.51 |
| ▸ | PAK4 | O96013 | 2/20 | 0.51 |
| ▸ | PIM1 | P11309 | 2/20 | 0.51 |
| ▸ | PRKACA | P17612 | 2/20 | 0.51 |
| ▸ | CDK2 | P24941 | 2/20 | 0.51 |
| ▸ | FLT3 | P36888 | 2/20 | 0.51 |
| ▸ | CSNK1A1 | P48729 | 2/20 | 0.51 |
| ▸ | CLK2 | P49760 | 2/20 | 0.51 |
| ▸ | CDK9 | P50750 | 2/20 | 0.51 |
| ▸ | JAK3 | P52333 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL3894734 | 0.79 | KDR (0.69) | CYP1A2CYP3A4CYP2C9HIF1ASYK | |
| SCHEMBL7764656 | 0.77 | ALDH1A1 (0.48) | HSD17B10FLT1PDGFRBPDGFRAKDM4E | |
| SCHEMBL7081454 | 0.76 | SYK (0.53) | CYP1A2CYP3A4CYP2D6CYP2C9HIF1A | |
| SCHEMBL9488233 | 0.74 | DHODH (0.55) | EGFRMAPK1ITKALDH1A1MAPT | |
| SCHEMBL3778709 | 0.74 | KDR (0.47) | CYP1A2CYP3A4CYP2D6CYP2C9HIF1A | |
| SCHEMBL26395885 | 0.74 | PDGFRB (0.58) | CYP1A2CYP3A4CYP2D6CYP2C9HIF1A | |
| SCHEMBL9469652 | 0.73 | RAB9A (0.57) | MAPKAPK2CSNK2A1ALDH1A1MAPT | |
| SCHEMBL4435114 | 0.73 | KDR (0.65) | SYKKDRDAPK3PRKD3MAP4K4 | |
| SCHEMBL761284 | 0.73 | SYK (0.54) | CYP1A2CYP3A4CYP2D6CYP2C9HIF1A | |
| SCHEMBL1548213 | 0.72 | ALDH1A1 (0.69) | CYP1A2CYP3A4CYP2D6CYP2C9HIF1A |
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-2001078648-A2 | 6-METHYLNICOTINAMIDE DERIVATIVES AS ANTIVIRAL AGENTS | DONG WHA PHARM. IND. CO., LTD. (KR) | 2001-10-25 | — | — | WO | disclosed |