Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 1/20 | 0.57 |
| ▸ | MKNK1 | Q9BUB5 | 7/20 | 0.56 |
| ▸ | MKNK2 | Q9HBH9 | 7/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.49 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.45 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.45 |
| ▸ | KDR | P35968 | 1/20 | 0.45 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL133437 | 0.93 | KMO (0.64) | KMOMKNK1MKNK2ALDH1A1CYP2A6 | |
| SCHEMBL12068188 | 0.86 | CYP2A6 (0.68) | MKNK1MKNK2ALDH1A1CYP2A6CYP1A2 | |
| SCHEMBL12070033 | 0.86 | CYP2A6 (0.68) | MKNK1MKNK2ALDH1A1CYP2A6CYP1A2 | |
| SCHEMBL133997 | 0.86 | LMNA (0.50) | ALDH1A1CYP1A2CYP3A4KDM4ELMNA | |
| SCHEMBL24492814 | 0.82 | CYP2A6 (0.62) | KMOMKNK1MKNK2ALDH1A1CYP2A6 | |
| SCHEMBL17694301 | 0.82 | CYP2A6 (0.62) | KMOMKNK1MKNK2ALDH1A1CYP2A6 | |
| SCHEMBL22428552 | 0.82 | CYP2A6 (0.62) | KMOMKNK1MKNK2ALDH1A1CYP2A6 | |
| SCHEMBL22428539 | 0.82 | CYP2A6 (0.62) | KMOMKNK1MKNK2ALDH1A1CYP2A6 | |
| SCHEMBL16577179 | 0.82 | CYP2A6 (0.62) | KMOMKNK1MKNK2ALDH1A1CYP2A6 | |
| SCHEMBL27605046 | 0.81 | KMO (0.77) | KMOMKNK1MKNK2ALDH1A1CYP2A6 |
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-9112172-B2 | Organic electroluminescence device | MERCK PATENT GMBH (DE) | 2015-08-18 | — | — | US | disclosed |
| US-9112172-B2 | Organic electroluminescence device | MERCK PATENT GMBH (DE) | 2015-08-18 | — | — | US | disclosed |
| US-20120037896-A1 | ORGANIC ELECTROLUMINESCENCE DEVICE | MERCK PATENT GMBH (DE) | 2012-02-16 | — | — | US | disclosed |
| US-20120037896-A1 | ORGANIC ELECTROLUMINESCENCE DEVICE | MERCK PATENT GMBH (DE) | 2012-02-16 | — | — | US | disclosed |