Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 6/20 | 0.57 |
| ▸ | MAOB | P27338 | 2/20 | 0.47 |
| ▸ | ESR1 | P03372 | 2/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.45 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL15906334 | 0.90 | MAOB (0.53) | PTGS2MAOBCYP1B1CES2CES1 | |
| SCHEMBL15900234 | 0.90 | MAOB (0.53) | PTGS2MAOBCYP1B1CES2CES1 | |
| SCHEMBL15907942 | 0.84 | ESR1 (0.46) | PTGS2ESR1CYP19A1CYP11B2CYP1B1 | |
| SCHEMBL2044831 | 0.83 | MAOB (0.50) | PTGS2MAOBCYP19A1CYP11B2CYP1B1 | |
| SCHEMBL2044828 | 0.83 | MAOB (0.50) | PTGS2MAOBCYP19A1CYP11B2CYP1B1 | |
| SCHEMBL2212093 | 0.81 | CYP19A1 (0.45) | PTGS2ESR1CYP19A1CYP11B2ESR2 | |
| SCHEMBL2211461 | 0.81 | CYP19A1 (0.45) | PTGS2ESR1CYP19A1CYP11B2ESR2 | |
| SCHEMBL2211464 | 0.81 | CYP19A1 (0.45) | PTGS2ESR1CYP19A1CYP11B2ESR2 | |
| SCHEMBL2212097 | 0.81 | CYP19A1 (0.45) | PTGS2ESR1CYP19A1CYP11B2ESR2 | |
| SCHEMBL14960838 | 0.81 | ESR1 (0.67) | PTGS2ESR1CYP19A1CYP11B2CYP1B1 |
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-9128393-B2 | Triphenylamine derivative, and charge transport material and electrophotographic photoreceptor using the same | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2015-09-08 | — | — | US | disclosed |
| US-20140213822-A1 | TRIPHENYLAMINE DERIVATIVE, AND CHARGE TRANSPORT MATERIAL AND ELECTROPHOTOGRAPHIC PHOTORECEPTOR USING THE SAME | TAKASAGO INTERNATIONAL CORPORATION (JP) | 2014-07-31 | — | — | US | disclosed |