Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 5/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 2/20 | 0.40 |
| ▸ | CNR2 | P34972 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | ACHE | P22303 | 3/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL15171997 | 0.87 | ALDH1A1 (0.37) | KIF11CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL4796677 | 0.83 | MEN1 (0.44) | KIF11CYP3A4LMNAACHEPOLB | |
| Dimethylamine SCHEMBL8511811 | 0.83 | KCNN4 (0.43) | CYP3A4CYP2C9CYP2C19ALDH1A1MEN1 | |
| SCHEMBL362964 | 0.82 | TSHR (0.43) | CYP3A4CYP2C9CYP2C19ALDH1A1MEN1 | |
| SCHEMBL15171994 | 0.80 | ESR1 (0.37) | CYP2D6CYP2C19LMNAALDH1A1MEN1 | |
| SCHEMBL11077750 | 0.79 | CYP19A1 (0.42) | KIF11LMNACHRM3NPSR1MEN1 | |
| SCHEMBL11575017 | 0.79 | ALDH1A1 (0.33) | ALDH1A1TSHR | |
| SCHEMBL8120662 | 0.79 | KCNN4 (0.47) | KIF11CHRM2CHRM3ALDH1A1 | |
| SCHEMBL8131087 | 0.78 | KIF11 (0.44) | KIF11CYP3A4LMNAACHECHRM3 | |
| SCHEMBL9667981 | 0.78 | MEN1 (0.50) | KIF11CYP3A4CYP2D6LMNAALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0755527-B1 | PHOTOCHROMIC NAPHTHOPYRAN COMPOUNDS | PPG IND OHIO INC (US) | 2000-03-15 | — | — | EP | disclosed |
| US-5674432-A | USED FOR OPHTHALMIC LENSES | TRANSITIONS OPTICAL, INC. (US) | 1997-10-07 | — | — | US | disclosed |
| EP-0755527-A4 | PHOTOCHROMIC NAPHTHOPYRAN COMPOUNDS | PPG INDUSTRIES INC (US) | 1997-06-18 | — | — | EP | disclosed |
| EP-0755527-A1 | PHOTOCHROMIC NAPHTHOPYRAN COMPOUNDS | PPG INDUSTRIES, INC. (US) | 1997-01-29 | — | — | EP | disclosed |
| US-5565147-A | OPHTHALMIC LENSES | TRANSITIONS OPTICAL, INC. (US) | 1996-10-15 | — | — | US | disclosed |
| WO-1995027914-A1 | PHOTOCHROMIC NAPHTHOPYRAN COMPOUNDS | PPG INDUSTRIES, INC. (US) | 1995-10-19 | — | — | WO | disclosed |
| US-5451344-A | Opthalmic lenses or transparencies for photochromic compounds | TRANSITIONS OPTICAL, INC. (US) | 1995-09-19 | — | — | US | disclosed |