Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 17/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
| ▸ | PKN1 | Q16512 | 2/20 | 0.32 |
| ▸ | PKN2 | Q16513 | 2/20 | 0.32 |
| ▸ | DHODH | Q02127 | 2/20 | 0.32 |
| ▸ | PLK4 | O00444 | 1/20 | 0.32 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.32 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.32 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.32 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.32 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.32 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.32 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.32 |
| ▸ | PIM1 | P11309 | 1/20 | 0.32 |
| ▸ | PHKG2 | P15735 | 1/20 | 0.32 |
| ▸ | PRKACA | P17612 | 1/20 | 0.32 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.32 |
| ▸ | CSNK1D | P48730 | 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 | |
|---|---|---|---|---|
| SCHEMBL9590336 | 0.93 | PARP1 (0.35) | PARP1CYP1A2CYP2D6GRIN2BPKN1 | |
| SCHEMBL9590755 | 0.91 | PARP1 (0.35) | PARP1CYP1A2CYP2D6GRIN2BPKN1 | |
| SCHEMBL9589444 | 0.88 | PARP1 (0.37) | PARP1CYP1A2CYP2D6GRIN2BPKN1 | |
| SCHEMBL9589820 | 0.86 | PNP (0.37) | PARP1CYP1A2CYP2D6GRIN2BPKN1 | |
| SCHEMBL9588065 | 0.83 | GRIN2B (0.43) | PARP1CYP1A2CYP2D6GRIN2BPKN1 | |
| SCHEMBL9589206 | 0.82 | GRIN2D (0.32) | GRIN2BDHODH | |
| SCHEMBL9589858 | 0.80 | CHRM1 (0.39) | PARP1CYP1A2CYP2D6GRIN2BDHODH | |
| SCHEMBL9590080 | 0.80 | — | — | |
| SCHEMBL9589401 | 0.80 | PARP1 (0.36) | PARP1PKN1PKN2DHODHPLK4 | |
| SCHEMBL9592001 | 0.77 | GRIN2B (0.42) | PARP1CYP1A2CYP2D6GRIN2BDHODH |
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 |
|---|---|---|---|---|---|---|---|
| US-5216003-A | Antihypoxic, antiischemic agents | G. D. SEARLE & CO. (US) | 1993-06-01 | — | — | US | disclosed |