Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERBB2 | P04626 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | FYN | P06241 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | AHR | P35869 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL16788714 | 0.92 | ERBB2 (0.31) | ERBB2CYP1A2FYNMAOAACHE | |
| SCHEMBL16788664 | 0.92 | TYMS (0.31) | — | |
| SCHEMBL16369526 | 0.89 | TYMS (0.31) | — | |
| SCHEMBL16788720 | 0.86 | ERBB2 (0.33) | ERBB2CYP1A2FYNMAOAACHE | |
| SCHEMBL16369535 | 0.84 | TYMS (0.31) | — | |
| SCHEMBL14849732 | 0.83 | ERBB2 (0.31) | ERBB2CYP1A2FYNMAOAACHE | |
| SCHEMBL16788680 | 0.82 | CYP1A2 (0.41) | ERBB2CYP1A2FYNMAOAACHE | |
| SCHEMBL2609875 | 0.82 | — | — | |
| SCHEMBL16788684 | 0.81 | CYP1A2 (0.42) | ERBB2CYP1A2FYNMAOAACHE | |
| SCHEMBL16520463 | 0.81 | TYMS (0.31) | — |
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-9553271-B2 | Compound and organic light-emitting device including the same | SAMSUNG DISPLAY CO., LTD. (KR) | 2017-01-24 | — | — | US | disclosed |
| US-9553271-B2 | Compound and organic light-emitting device including the same | SAMSUNG DISPLAY CO., LTD. (KR) | 2017-01-24 | — | — | US | disclosed |
| US-20150162540-A1 | COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | SAMSUNG DISPLAY CO., LTD. (KR) | 2015-06-11 | — | — | US | disclosed |
| US-20150162540-A1 | COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | SAMSUNG DISPLAY CO., LTD. (KR) | 2015-06-11 | — | — | US | disclosed |