Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.46 |
| ▸ | FYN | P06241 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | AHR | P35869 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.45 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.45 |
| ▸ | HPRT1 | P00492 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1309270 | 0.87 | ALDH1A1 (0.50) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL30476322 | 0.84 | CYP1A2 (0.46) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL29265552 | 0.82 | HPRT1 (0.52) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL220864 | 0.81 | CYP1A2 (0.44) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL722895 | 0.79 | ALDH1A1 (0.39) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL164352 | 0.77 | ALDH1A1 (0.40) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL29663893 | 0.77 | ALDH1A1 (0.40) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL18740448 | 0.76 | HSD17B10 (0.44) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL160528 | 0.75 | ALDH1A1 (0.39) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL29634291 | 0.75 | ALDH1A1 (0.39) | CYP1A2ERBB2FYNMAOAACHE |
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-0958514-B1 | NOVEL PHOTOCHROMIC HETEROCYCLIC FUSED INDENONAPHTHOPYRANS | TRANSITIONS OPTICAL INC (US) | 2005-01-26 | — | — | EP | disclosed |
| US-6478988-B1 | Photochromic substituted naphthopyran compounds | BMC VISION-EASE LENS, INC. | 2002-11-12 | — | — | US | disclosed |
| EP-1016702-A2 | Photochromic substituted naphthopyran compounds | BMC Vision-Ease Lens Inc. (US) | 2000-07-05 | — | — | EP | disclosed |