Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.64 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.48 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.48 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.46 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.45 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.45 |
| ▸ | CCR4 | P51679 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1922073 | 0.85 | NPSR1 (0.72) | NPSR1NFKB1MAPTCYP1A2CYP3A4 | |
| SCHEMBL28613252 | 0.84 | NPSR1 (0.55) | NPSR1NFKB1MAPTCYP1A2CYP3A4 | |
| SCHEMBL30074722 | 0.83 | CDC25B (0.67) | NPSR1NFKB1MAPTCYP3A4HTT | |
| SCHEMBL2582572 | 0.83 | CDC25B (0.67) | NPSR1NFKB1MAPTCYP3A4HTT | |
| SCHEMBL30003996 | 0.82 | CYP3A4 (0.68) | NPSR1NFKB1MAPTCYP1A2CYP3A4 | |
| SCHEMBL3976447 | 0.82 | CYP3A4 (0.68) | NPSR1NFKB1MAPTCYP1A2CYP3A4 | |
| SCHEMBL29650380 | 0.80 | NPSR1 (0.86) | NPSR1NFKB1MAPTCYP1A2CYP3A4 | |
| SCHEMBL1009206 | 0.80 | NPSR1 (0.86) | NPSR1NFKB1MAPTCYP1A2CYP3A4 | |
| SCHEMBL3690304 | 0.80 | NPSR1 (0.64) | NPSR1NFKB1MAPTCYP1A2CYP3A4 | |
| SCHEMBL234363 | 0.79 | NPSR1 (1.00) | NPSR1NFKB1MAPTCYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0713148-B1 | Naphthylenediamine derivative and electrophotosensitive material using the same | KYOCERA MITA CORP (JP) | 2002-03-13 | — | — | EP | disclosed |
| US-5830615-A | ELECTRIC CHARGE TRANSFERRING CAPABILITY, COMPATIBILITY, DURABILITY | MITA INDUSTRIAL CO., LTD. (JP) | 1998-11-03 | — | — | US | disclosed |
| EP-0713148-A1 | Naphthylenediamine derivative and electrophotosensitive material using the same | MITA INDUSTRIAL CO. LTD. (JP) | 1996-05-22 | — | — | EP | disclosed |