Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CB | P42338 | 1/20 | 0.39 |
| ▸ | PRKCI | P41743 | 1/20 | 0.34 |
| ▸ | NOS3 | P29474 | 2/20 | 0.31 |
| ▸ | NOS2 | P35228 | 2/20 | 0.31 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | DHFR | P00374 | 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 | |
|---|---|---|---|---|
| SCHEMBL7646554 | 1.00 | PIK3CB (0.39) | PIK3CBPRKCINOS3NOS2NOS1 | |
| SCHEMBL7644422 | 0.75 | NNMT (0.32) | — | |
| SCHEMBL7641636 | 0.72 | KMT2A (0.47) | — | |
| SCHEMBL7647192 | 0.71 | SMPD3 (0.42) | — | |
| SCHEMBL19929 | 0.70 | — | — | |
| SCHEMBL27952255 | 0.70 | PIK3CB (0.41) | PIK3CBPRKCINOS3NOS2NOS1 | |
| Iodide SCHEMBL29172953 | 0.68 | PIK3CB (0.40) | PIK3CBPRKCINOS3NOS2NOS1 | |
| Hydrochloric Acid SCHEMBL6853659 | 0.68 | PIK3CB (0.40) | PIK3CBPRKCINOS3NOS2NOS1 | |
| SCHEMBL15091312 | 0.64 | PIK3CB (0.44) | PIK3CBPRKCINOS3NOS2NOS1 | |
| SCHEMBL7639762 | 0.64 | — | — |
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-2002074267-A1 | NOVEL DYEING COMPOSITIONS FOR THE DYEING OF KERATIN FIBRES COMPRISING 6-MEMBERED HETEROCYCLIC HYDRAZONE COMPOUNDS AS AN OXIDATION BASE | L'OREAL (FR) | 2002-09-26 | — | — | WO | disclosed |