Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CA12 | O43570 | 5/20 | 0.41 |
| ▸ | CA1 | P00915 | 5/20 | 0.41 |
| ▸ | CA2 | P00918 | 5/20 | 0.41 |
| ▸ | CA9 | Q16790 | 5/20 | 0.41 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.41 |
| ▸ | FYN | P06241 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | AHR | P35869 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.39 |
| ▸ | FNTA | P49354 | 1/20 | 0.38 |
| ▸ | FNTB | P49356 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL15731070 | 0.93 | CYP1A2 (0.47) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL31505497 | 0.88 | CYP1A2 (0.50) | CYP1A2CA12CA1CA2CA9 | |
| SCHEMBL16557787 | 0.86 | NPSR1 (0.44) | CYP1A2CA12CA1CA2CA9 | |
| SCHEMBL27697459 | 0.86 | CYP1A2 (0.53) | CYP1A2CA12CA1CA2CA9 | |
| SCHEMBL16792034 | 0.82 | CA12 (0.53) | CYP1A2CA12CA1CA2CA9 | |
| SCHEMBL947346 | 0.82 | CYP1A2 (0.52) | CYP1A2CA12CA1CA2CA9 | |
| SCHEMBL29490404 | 0.82 | CYP1A2 (0.52) | CYP1A2CA12CA1CA2CA9 | |
| SCHEMBL19911017 | 0.79 | ALDH1A1 (0.47) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL17849708 | 0.79 | CYP1A2 (0.37) | CYP1A2ERBB2FYNMAOAACHE | |
| SCHEMBL12192912 | 0.79 | CA12 (0.47) | CYP1A2CA12CA1CA2CA9 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9680106-B2 | Pyrene-based compound and organic light-emitting device including the same | SAMSUNG DISPLAY CO., LTD. (KR) | 2017-06-13 | — | — | US | disclosed |
| US-9680106-B2 | Pyrene-based compound and organic light-emitting device including the same | SAMSUNG DISPLAY CO., LTD. (KR) | 2017-06-13 | — | — | US | disclosed |
| US-20150090967-A1 | PYRENE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | SAMSUNG DISPLAY CO., LTD. (KR) | 2015-04-02 | — | — | US | disclosed |
| US-20150090967-A1 | PYRENE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | SAMSUNG DISPLAY CO., LTD. (KR) | 2015-04-02 | — | — | US | disclosed |