Known targets — ChEMBL curated mechanism
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
The experimentally established mechanism targets of Diphenylamine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.63 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.63 |
| ▸ | TSHR | P16473 | 3/20 | 0.63 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.63 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.63 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.63 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.63 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.63 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.63 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.63 |
| ▸ | HTR2B | P41595 | 1/20 | 0.63 |
| ▸ | SNCA | P37840 | 1/20 | 0.57 |
| ▸ | CASP3 | P42574 | 1/20 | 0.56 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 5/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | AR | P10275 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| Diphenylamine SCHEMBL28015233 | 1.00 | HSD17B10 (0.67) | HSD17B10ALDH1A1TSHRTDP1L3MBTL1 | |
| Diphenylamine SCHEMBL1008717 | 1.00 | HSD17B10 (0.67) | HSD17B10ALDH1A1TSHRTDP1L3MBTL1 | |
| Diphenylamine SCHEMBL5145295 | 0.97 | HSD17B10 (0.63) | HSD17B10ALDH1A1TSHRTDP1L3MBTL1 | |
| Diphenylamine SCHEMBL7079615 | 0.95 | HSD17B10 (0.60) | HSD17B10ALDH1A1TSHRTDP1L3MBTL1 | |
| Diphenylamine SCHEMBL28870226 | 0.95 | HSD17B10 (0.60) | HSD17B10ALDH1A1TSHRTDP1L3MBTL1 | |
| Diphenylamine SCHEMBL1626446 | 0.91 | MAPT (0.61) | HSD17B10ALDH1A1TSHRTDP1L3MBTL1 | |
| Diphenylamine SCHEMBL5665558 | 0.90 | HSD17B10 (0.60) | HSD17B10ALDH1A1TSHRTDP1L3MBTL1 | |
| Sulfuric Acid SCHEMBL970713 | 0.87 | MAPT (0.75) | HSD17B10ALDH1A1TSHRTDP1L3MBTL1 | |
| Diphenylamine SCHEMBL28417536 | 0.85 | TSHR (0.73) | HSD17B10ALDH1A1TSHRTDP1L3MBTL1 | |
| Diphenylamine SCHEMBL28944887 | 0.85 | HSD17B10 (0.55) | HSD17B10ALDH1A1TSHRTDP1L3MBTL1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20110033716-A1 | GAS-BARRIER COMPOSITION, COATING FILM, PROCESS FOR PRODUCING THE SAME, AND LAYERED MATERIAL | MITSUI CHEMICALS, INC. (JP) | 2011-02-10 | — | — | US | disclosed |
| US-7879947-B2 | Gas-barrier composition, coating film and method for production of the same, and layered material | MITSUI CHEMICALS, INC. (JP) | 2011-02-01 | — | — | US | disclosed |
| EP-2277954-A1 | GAS BARRIER COMPOSITION, COATING FILM, METHOD FOR PRODUCING THE GAS BARRIER COMPOSITION, METHOD FOR PRODUCING THE COATING FILM, AND MULTILAYER BODY | Mitsui Chemicals, Inc. (JP) | 2011-01-26 | — | — | EP | disclosed |
| US-20090171003-A1 | Gas-barrier composition, coating film and method for production of the same, and layered material | MITSUI CHEMICALS, INC. (JP) | 2009-07-02 | — | — | US | disclosed |
| US-7524900-B2 | Gas-barrier composition, coating film and method for production of the same, and layered material | MITSUI CHEMICALS, INC. (JP) | 2009-04-28 | — | — | US | disclosed |
| EP-1894971-A1 | GAS BARRIER COMPOSITION, COATING FILM, METHODS FOR PRODUCING THOSE, AND MULTILAYER BODY | Mitsui Chemicals, Inc. (JP) | 2008-03-05 | — | — | EP | disclosed |
| US-20060293448-A1 | Gas-barrier composition, coating film and method for production of the same, and layered material | MITSUI CHEMICALS, INC. (JP) | 2006-12-28 | — | — | US | disclosed |