Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD3 | Q9NY59 | 3/20 | 0.41 |
| ▸ | AXL | P30530 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.33 |
| ▸ | JAK2 | O60674 | 3/20 | 0.32 |
| ▸ | NPC1 | O15118 | 3/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.32 |
| ▸ | BMP4 | P12644 | 1/20 | 0.32 |
| ▸ | JAK1 | P23458 | 2/20 | 0.32 |
| ▸ | TYK2 | P29597 | 2/20 | 0.32 |
| ▸ | JAK3 | P52333 | 2/20 | 0.32 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 3/20 | 0.31 |
| ▸ | MITF | O75030 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9923288 | 0.76 | CDK2 (0.60) | SMPD3AXLCDK2KDM4ESMN1; SMN2 | |
| SCHEMBL446361 | 0.72 | SMPD3 (0.38) | SMPD3AXLCDK2KDM4EPKM | |
| SCHEMBL179552 | 0.68 | PDE10A (0.38) | SMPD3AXLCDK2KDM4EHTT | |
| SCHEMBL3021418 | 0.68 | HPGD (0.33) | SMN1; SMN2NPC1RAB9AHTTALDH1A1 | |
| SCHEMBL24369807 | 0.68 | NUDT1 (0.36) | SMPD3NUDT1 | |
| SCHEMBL15556011 | 0.67 | AXL (0.60) | SMPD3AXLCDK2SMN1; SMN2NPC1 | |
| SCHEMBL3010623 | 0.65 | HPGD (0.35) | SMN1; SMN2NPC1RAB9AALDH1A1 | |
| Hydrochloric Acid SCHEMBL31619228 | 0.65 | SMPD3 (0.41) | SMPD3AXLCDK2KDM4EHSD17B10 | |
| SCHEMBL22857928 | 0.63 | AXL (0.42) | SMPD3AXLKDM4ESMN1; SMN2NPC1 | |
| SCHEMBL22490643 | 0.62 | GRIN2D (0.40) | CDK2NUDT1GRIN2DGRIN3BGRIA1 |
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-0381132-A1 | Imidazopyridazines, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1990-08-08 | — | — | EP | disclosed |