Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 2/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
| ▸ | AURKA | O14965 | 1/20 | 0.32 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.32 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.32 |
| ▸ | RET | P07949 | 1/20 | 0.32 |
| ▸ | IGF1R | P08069 | 1/20 | 0.32 |
| ▸ | MET | P08581 | 1/20 | 0.32 |
| ▸ | PIM1 | P11309 | 1/20 | 0.32 |
| ▸ | LTK | P29376 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.32 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.32 |
| ▸ | CDK8 | P49336 | 1/20 | 0.32 |
| ▸ | CLK2 | P49760 | 1/20 | 0.32 |
| ▸ | CDK9 | P50750 | 1/20 | 0.32 |
| ▸ | CDK5 | Q00535 | 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 | |
|---|---|---|---|---|
| SCHEMBL10600307 | 0.87 | GABRA1 (0.47) | GABRA1GABRB2PDE4BPDE4DAURKA | |
| SCHEMBL5403133 | 0.86 | GABRA1 (0.40) | GABRA1GABRB2PDE4BPDE4DELANE | |
| SCHEMBL473259 | 0.82 | DPP4 (0.38) | USP7GCGRKMT2APDCD1CD274 | |
| Water SCHEMBL474768 | 0.80 | DPP4 (0.37) | USP7GCGRKMT2APDCD1CD274 | |
| SCHEMBL8605193 | 0.80 | GABRA1 (0.36) | GABRA1GABRB2PDE4BPDE4DAURKA | |
| SCHEMBL9859732 | 0.78 | GABRA1 (0.37) | GABRA1GABRB2PDE4BPDE4DELANE | |
| SCHEMBL7194462 | 0.78 | GABRA1 (0.36) | GABRA1GABRB2ELANEPOLBMAPK1 | |
| SCHEMBL21753489 | 0.77 | DPP4 (0.34) | USP7GCGRPDCD1CD274DPP4 | |
| SCHEMBL2362467 | 0.77 | GABRA1 (0.52) | GABRA1GABRB2AURKADAPK3MAP4K4 | |
| SCHEMBL5617569 | 0.77 | GABRA1 (0.36) | GABRA1GABRB2AURKADAPK3MAP4K4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-5140003-A | — | — | None | — | — | JP | disclosed |
| JP-H05140003-A | PRODUCTN OF ALKYL SUBSTITUTED AROMATIC HYDROCARBON | NIPPON PETROCHEM CO LTD | 1993-06-08 | — | — | JP | disclosed |