Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTK2 | Q05397 | 5/20 | 0.39 |
| ▸ | SYK | P43405 | 1/20 | 0.34 |
| ▸ | ATP4A | P20648 | 4/20 | 0.33 |
| ▸ | ATP4B | P51164 | 4/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MGAM | O43451 | 3/20 | 0.32 |
| ▸ | GAA | P10253 | 3/20 | 0.32 |
| ▸ | SI | P14410 | 3/20 | 0.32 |
| ▸ | MGAM2 | Q2M2H8 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21953819 | 0.78 | CYSLTR2 (0.42) | PTK2SYKRAB9ANPC1HSD17B10 | |
| SCHEMBL1674327 | 0.77 | PTK2 (0.44) | PTK2SYKRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL1682805 | 0.71 | PTK2 (0.45) | PTK2SYKRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL1682796 | 0.68 | PTK2 (0.50) | PTK2SYKRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL367112 | 0.68 | SYK (0.41) | SYK | |
| SCHEMBL29963047 | 0.68 | SYK (0.41) | SYK | |
| SCHEMBL1682843 | 0.67 | PTK2 (0.50) | PTK2 | |
| SCHEMBL1674220 | 0.66 | SYK (0.39) | SYK | |
| SCHEMBL21953511 | 0.66 | SYK (0.38) | PTK2SYKSMN1; SMN2MAPTHTT | |
| SCHEMBL29237867 | 0.65 | CYP3A4 (0.47) | RAB9ANPC1SMN1; SMN2MGAMGAA |
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-2020085742-A1 | HETEROAROMATIC MACROCYCLIC DERIVATIVES AS PROTEIN KINASE INHIBITORS | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2020-04-30 | — | — | WO | disclosed |