Known targets — ChEMBL curated mechanism
BTKCACNA1CCACNA1DCACNA1FCACNA1SCACNA2D1CACNA2D2DRD2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQHRH1HTR2AP2RY12
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 | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.73 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.73 |
| ▸ | SNCA | P37840 | 1/20 | 0.65 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.55 |
| ▸ | NSD2 | O96028 | 2/20 | 0.54 |
| ▸ | CASP6 | P55212 | 2/20 | 0.54 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.54 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.54 |
| ▸ | CASP7 | P55210 | 1/20 | 0.54 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.52 |
| ▸ | HTR2B | P41595 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL315795 | 0.93 | SNCA (0.73) | TSHRSMN1; SMN2SNCAHSD17B10NSD2 | |
| SCHEMBL9479439 | 0.93 | SNCA (0.73) | TSHRSMN1; SMN2SNCAHSD17B10NSD2 | |
| SCHEMBL6865288 | 0.88 | SNCA (0.72) | TSHRSMN1; SMN2SNCAHSD17B10NSD2 | |
| SCHEMBL9717494 | 0.87 | SNCA (0.76) | TSHRSMN1; SMN2SNCAHSD17B10NSD2 | |
| Diphenylamine SCHEMBL1008716 | 0.85 | HSD17B10 (0.67) | TSHRSNCAHSD17B10NSD2CASP6 | |
| Diphenylamine SCHEMBL1008717 | 0.85 | HSD17B10 (0.67) | TSHRSNCAHSD17B10NSD2CASP6 | |
| Diphenylamine SCHEMBL28015233 | 0.85 | HSD17B10 (0.67) | TSHRSNCAHSD17B10NSD2CASP6 | |
| SCHEMBL3409457 | 0.85 | TSHR (1.00) | TSHRSMN1; SMN2SNCAHSD17B10DUSP3 | |
| Benzene SCHEMBL9751882 | 0.85 | TSHR (1.00) | TSHRSMN1; SMN2SNCAHSD17B10DUSP3 | |
| SCHEMBL30307036 | 0.85 | TSHR (1.00) | TSHRSMN1; SMN2SNCAHSD17B10DUSP3 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112513016-B | Sulfur-containing polymerizable monomer and use thereof | 尚美德齿科材料有限公司 | 2023-12-19 | — | — | CN | disclosed |
| CN-112940432-B | Polymerizable monomer for dental material, composition, adhesive dental material, and kit | 三井化学株式会社 | 2022-12-30 | — | — | CN | disclosed |
| CN-107427414-B | Polymerizable monomer for dental material, composition, adhesive dental material, and kit | 三井化学株式会社 | 2021-07-02 | — | — | CN | disclosed |
| CN-112940432-A | Polymerizable monomer for dental material, composition, adhesive dental material, and kit | 三井化学株式会社 | 2021-06-11 | — | — | CN | disclosed |
| CN-112513016-A | Sulfur-containing polymerizable monomer and use thereof | 尚美德齿科材料有限公司 | 2021-03-16 | — | — | CN | disclosed |
| CN-106535815-B | Reactive micro-applicator with metal-containing additives for applying dental adhesives | 古莎有限公司 | 2020-05-29 | — | — | CN | disclosed |