Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 7/20 | 0.35 |
| ▸ | PHGDH | O43175 | 1/20 | 0.35 |
| ▸ | WDR91 | A4D1P6 | 1/20 | 0.33 |
| ▸ | P2RY12 | Q9H244 | 3/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.31 |
| ▸ | CYP21A2 | P08686 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | ABL1 | P00519 | 1/20 | 0.31 |
| ▸ | LGMN | Q99538 | 1/20 | 0.31 |
| ▸ | RORC | P51449 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13327502 | 0.98 | PHGDH (0.34) | ACACBPHGDHWDR91P2RY12CYP17A1 | |
| SCHEMBL21005460 | 0.94 | PHGDH (0.33) | ACACBPHGDHWDR91P2RY12CYP17A1 | |
| SCHEMBL13327519 | 0.88 | PHGDH (0.35) | ACACBPHGDHWDR91P2RY12CYP17A1 | |
| SCHEMBL13327499 | 0.87 | ACACB (0.33) | ACACBPHGDHCYP17A1CYP21A2CYP11B1 | |
| SCHEMBL13327506 | 0.86 | PHGDH (0.37) | PHGDHWDR91P2RY12ABL1RORC | |
| SCHEMBL19649072 | 0.86 | — | — | |
| SCHEMBL19903955 | 0.82 | ACHE (0.33) | ACACBPHGDHCYP17A1CYP21A2CYP11B1 | |
| SCHEMBL18774380 | 0.80 | ACHE (0.31) | ACACB | |
| SCHEMBL13327520 | 0.80 | ACHE (0.31) | ACACBPHGDHCYP17A1CYP21A2CYP11B1 | |
| SCHEMBL13799669 | 0.79 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2677996-B1 | COMPOSITION FOR DYEING KERATINOUS FIBRES COMPRISING A DIRECT DYE HAVING A DISULPHIDE/THIOL FUNCTIONAL GROUP, A THICKENING POLYMER, AN ETHOXYLATED FATTY ALCOHOL AND/OR A NONIONIC SURFACTANT, AN ALKALINE AGENT AND A REDUCING AGENT | L'ORÉAL (FR) | 2017-11-29 | — | — | EP | disclosed |