Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.58 |
| ▸ | CA12 | O43570 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | CA2 | P00918 | 2/20 | 0.58 |
| ▸ | CA9 | Q16790 | 2/20 | 0.58 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | CA5A | P35218 | 1/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.58 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.58 |
| ▸ | APP | P05067 | 1/20 | 0.48 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.48 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.48 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.46 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.46 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2859448 | 0.93 | CYP3A4 (0.50) | CYP3A4CA12ALDH1A1CA2CA9 | |
| SCHEMBL21393012 | 0.93 | CYP3A4 (0.57) | CYP3A4CA12ALDH1A1CA2CA9 | |
| SCHEMBL4494616 | 0.85 | CYP3A4 (0.53) | CYP3A4CA12ALDH1A1CA2CA9 | |
| SCHEMBL30358272 | 0.83 | CYP3A4 (0.58) | CYP3A4CA12ALDH1A1CA2CA9 | |
| SCHEMBL813557 | 0.83 | CYP3A4 (0.58) | CYP3A4CA12ALDH1A1CA2CA9 | |
| SCHEMBL3182473 | 0.81 | CYP3A4 (0.55) | CYP3A4CA12ALDH1A1CA2CA9 | |
| SCHEMBL5143789 | 0.81 | CYP3A4 (0.55) | CYP3A4CA12ALDH1A1CA2CA9 | |
| SCHEMBL7262618 | 0.81 | — | — | |
| SCHEMBL29719326 | 0.81 | CYP3A4 (0.55) | CYP3A4CA12ALDH1A1CA2CA9 | |
| SCHEMBL27530842 | 0.80 | CYP3A4 (0.48) | CYP3A4CA12ALDH1A1CA2CA9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0785936-A4 | PHOTOCHROMIC NAPHTHOXAZINE COMPOUNDS | PPG INDUSTRIES INC (US) | 1998-07-08 | — | — | EP | claimed |
| EP-0785936-A1 | PHOTOCHROMIC NAPHTHOXAZINE COMPOUNDS | PPG INDUSTRIES, INC. (US) | 1997-07-30 | — | — | EP | claimed |