Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYMS | P04818 | 3/20 | 0.34 |
| ▸ | DHFR | P00374 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.31 |
| ▸ | FYN | P06241 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | AHR | P35869 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17849702 | 0.93 | CYP1A2 (0.35) | TYMSDHFRCYP1A2ERBB2FYN | |
| SCHEMBL15909679 | 0.82 | LPL (0.38) | CYP1A2 | |
| SCHEMBL17849708 | 0.79 | CYP1A2 (0.37) | TYMSDHFRCYP1A2ERBB2FYN | |
| SCHEMBL17849698 | 0.77 | MAOB (0.34) | TYMSMAOA | |
| SCHEMBL13888836 | 0.77 | MAOB (0.34) | TYMSMAOA | |
| SCHEMBL17849671 | 0.75 | PDK2 (0.30) | — | |
| SCHEMBL17849694 | 0.75 | CYP2A6 (0.41) | MAOANPSR1 | |
| SCHEMBL12982875 | 0.75 | NPSR1 (0.40) | TYMSDHFRCYP1A2ERBB2FYN | |
| SCHEMBL31591206 | 0.75 | MEN1 (0.34) | TYMSDHFRCYP1A2ERBB2FYN | |
| SCHEMBL12256088 | 0.75 | MEN1 (0.34) | TYMSDHFRCYP1A2ERBB2FYN |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9371270-B2 | Compound for organic light-emitting device and organic light-emitting device including the same | SAMSUNG DISPLAY CO., LTD. (KR) | 2016-06-21 | — | — | US | disclosed |
| US-9371270-B2 | Compound for organic light-emitting device and organic light-emitting device including the same | SAMSUNG DISPLAY CO., LTD. (KR) | 2016-06-21 | — | — | US | disclosed |