Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 9/20 | 0.42 |
| ▸ | ESR1 | P03372 | 3/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.37 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.36 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.35 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.34 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | LPL | P06858 | 1/20 | 0.33 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17243541 | 0.99 | PDK2 (0.41) | PDK2ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL20073103 | 0.99 | PDK2 (0.40) | PDK2ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL23179762 | 0.97 | PDK2 (0.40) | PDK2ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL23179638 | 0.96 | PDK2 (0.38) | PDK2ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL19567760 | 0.96 | PDK2 (0.43) | PDK2ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL13634135 | 0.96 | ESR1 (0.38) | PDK2ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL24647506 | 0.96 | ESR1 (0.38) | PDK2ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL22425475 | 0.96 | ESR1 (0.38) | PDK2ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL17412441 | 0.96 | ESR1 (0.40) | PDK2ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL21392552 | 0.96 | ESR1 (0.40) | PDK2ESR1ESR2HSD17B1HSD17B2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8980442-B2 | Aromatic amine derivative and organic electroluminescent element using same | MITSUI CHEMICALS, INC. (JP) | 2015-03-17 | — | — | US | disclosed |
| US-20120012832-A1 | AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME | MITSUI CHEMICALS, INC. (JP) | 2012-01-19 | — | — | US | disclosed |
| US-20120012832-A1 | AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME | MITSUI CHEMICALS, INC. (JP) | 2012-01-19 | — | — | 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-20120012832-A1 | AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME | MAOA, MAOB, TYR | PDK2 1940/4885ESR1 213/4885ESR2 685/4885 |
“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.