Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.63 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.63 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.63 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.63 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.63 |
| ▸ | CNR1 | P21554 | 2/20 | 0.50 |
| ▸ | CNR2 | P34972 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL2555282 | 0.93 | ESR1 (0.61) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL2035001 | 0.87 | POLB (0.51) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL2034409 | 0.87 | POLB (0.51) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL28459672 | 0.87 | ESR1 (0.61) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL28591660 | 0.87 | ESR1 (0.61) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| Hexadecyl Gallate SCHEMBL29376835 | 0.86 | ESR1 (0.70) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| Dodecyl Gallate SCHEMBL20450222 | 0.86 | ESR1 (0.70) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| Dodecyl Gallate SCHEMBL2328908 | 0.86 | ESR1 (0.70) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| Octyl_Gallate SCHEMBL29883664 | 0.86 | ESR1 (0.70) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| Octadecyl Gallate SCHEMBL29648937 | 0.86 | ESR1 (0.70) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20110192416-A1 | USE OF HYDROPHOBIN FOR NON-PERMANENT DYEING OF KERATIN | BASF SE (DE) | 2011-08-11 | — | — | US | disclosed |
| US-20110171283-A1 | COMPOSITION CONTAINING AT LEAST ONE NUTRIVITE, AT LEAST ONE DISINFECTING OR DECONTAMINATING, AND/OR AT LEAST ONE PROTEASE-INHIBITING ACTIVE COMPOUND AND/OR ACTIVE COMPOUND COMPLEX | RIESINGER BIRGIT | 2011-07-14 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20110192416-A1 | USE OF HYDROPHOBIN FOR NON-PERMANENT DYEING OF KERATIN | KRT18, VIM, CD68 | ESR1 4358/4885AKR1C4 838/4885AKR1C3 1014/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.