Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 1/20 | 0.52 |
| ▸ | XDH | P47989 | 1/20 | 0.52 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 3/20 | 0.45 |
| ▸ | CA2 | P00918 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | PIM1 | P11309 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL15856480 | 0.87 | MCL1 (0.47) | XDHMCL1MAOAMAOBCA1 | |
| SCHEMBL23625611 | 0.85 | GRM2 (0.52) | GRM2XDHTSHR | |
| SCHEMBL29038987 | 0.84 | CYP1A2 (0.49) | GRM2XDHMCL1MAOAMAOB | |
| SCHEMBL7624975 | 0.83 | GRM2 (0.49) | GRM2KDM4EALDH1A1GAAHPGD | |
| SCHEMBL28203557 | 0.81 | CA1 (0.60) | XDHMCL1CA1CA2PIM1 | |
| SCHEMBL3478696 | 0.80 | GRM2 (0.48) | GRM2MAOAMAOBCYP1A2CYP2A6 | |
| SCHEMBL15853131 | 0.80 | XDH (0.46) | XDHMCL1CA1CA2PIM1 | |
| SCHEMBL29293789 | 0.80 | TSHR (0.50) | GRM2ALOX15MEN1GLAHPGD | |
| SCHEMBL2353695 | 0.79 | CA1 (0.53) | XDHMCL1CA1CA2PIM1 | |
| SCHEMBL20561064 | 0.79 | MCL1 (0.58) | XDHMCL1CA1CA2CYP1A2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20140183468-A1 | PYRENE-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DIODE COMPRISING THE SAME | SAMSUNG DISPLAY CO., LTD. (KR) | 2014-07-03 | — | — | US | disclosed |