Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.33 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | GUSB | P08236 | 1/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | RET | P07949 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20708522 | 0.78 | NPC1 (0.54) | NPC1ALDH1A1SMN1; SMN2KDM4ERAB9A | |
| SCHEMBL15426464 | 0.76 | ALOX5AP (0.43) | NPC1ALDH1A1SMN1; SMN2KDM4ERAB9A | |
| SCHEMBL16746508 | 0.75 | CYP3A4 (0.44) | CYP1A2CYP3A4CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL15426278 | 0.74 | AKT1 (0.38) | ALDH1A1KDM4EMAPTGAACYP1A2 | |
| SCHEMBL15426414 | 0.74 | LMNA (0.34) | NPC1ALDH1A1SMN1; SMN2KDM4ERAB9A | |
| SCHEMBL15426364 | 0.74 | SGMS2 (0.38) | NPC1ALDH1A1SMN1; SMN2KDM4ERAB9A | |
| SCHEMBL15412909 | 0.74 | BRD4 (0.38) | KDM4EMAPTGAACYP1A2 | |
| SCHEMBL9634705 | 0.73 | PDE5A (0.44) | NPC1ALDH1A1SMN1; SMN2KDM4ERAB9A | |
| SCHEMBL20708865 | 0.73 | FGFR2 (0.34) | CYP1A2FGFR2FGFR3CYP3A4CYP2C9 | |
| SCHEMBL15426285 | 0.72 | BRD4 (0.39) | ALDH1A1SMN1; SMN2KDM4EMAPTGAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3006429-B1 | FUSED HETEROCYCLIC COMPOUND AND USE FOR PEST CONTROL THEREOF | SUMITOMO CHEMICAL CO (JP) | 2019-02-06 | — | — | EP | disclosed |