Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.31 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.30 |
| ▸ | DCPS | Q96C86 | 1/20 | 0.30 |
| ▸ | ADORA2A | P29274 | 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 | |
|---|---|---|---|---|
| SCHEMBL29400765 | 0.97 | CYP1A2 (0.32) | CYP1A2CASP1PIK3CGPDPK1DCPS | |
| Hydrochloric Acid SCHEMBL30706492 | 0.94 | CYP1A2 (0.31) | CYP1A2CASP1PIK3CGPDPK1DCPS | |
| SCHEMBL28067039 | 0.94 | CYP1A2 (0.31) | CYP1A2CASP1PIK3CGPDPK1DCPS | |
| SCHEMBL28837049 | 0.94 | CYP1A2 (0.31) | CYP1A2CASP1PIK3CGPDPK1DCPS | |
| Hydrochloric Acid SCHEMBL19858971 | 0.94 | CYP1A2 (0.31) | CYP1A2CASP1PIK3CGPDPK1DCPS | |
| Hydrogen Sulfide SCHEMBL28177577 | 0.94 | CYP1A2 (0.31) | CYP1A2CASP1PIK3CGPDPK1DCPS | |
| Hydrochloric Acid SCHEMBL3763676 | 0.94 | CYP1A2 (0.31) | CYP1A2CASP1PIK3CGPDPK1DCPS | |
| Hydrochloric Acid SCHEMBL19858970 | 0.94 | CYP1A2 (0.31) | CYP1A2CASP1PIK3CGPDPK1DCPS | |
| SCHEMBL6409173 | 0.93 | — | — | |
| SCHEMBL5391923 | 0.87 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1197202-B1 | Hair dye composition comprising 2,6-diaminopurine | KPSS KAO GMBH (DE) | 2003-07-09 | — | — | EP | claimed |
| EP-0943319-B1 | Hair-dye | KPSS KAO GMBH (DE) | 2003-06-18 | — | — | EP | claimed |
| EP-1197202-A1 | Hair dye composition comprising 2,6-diaminopurine | GOLDWELL GmbH (DE) | 2002-04-17 | — | — | EP | claimed |
| EP-1103248-A1 | Hair dyeing composition comprising N-ethyl-N-isopropyl-p-phenylenediamine | GOLDWELL GmbH (DE) | 2001-05-30 | — | — | EP | claimed |
| EP-0943319-A2 | Hair-dye | GOLDWELL GmbH (DE) | 1999-09-22 | — | — | EP | claimed |