Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.45 |
| ▸ | CCR2 | P41597 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | TNKS | O95271 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.32 |
| ▸ | COPS5 | Q92905 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | HK2 | P52789 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8665295 | 0.79 | CYP2A6 (0.45) | CYP1A2CYP2A6ALDH1A1HTTKDM4E | |
| SCHEMBL8666867 | 0.79 | IDO1 (0.42) | L3MBTL1TNKSTNKS2HPGD | |
| SCHEMBL81799 | 0.78 | ALDH1A1 (0.38) | ALDH1A1L3MBTL1TNKSPARP1TNKS2 | |
| SCHEMBL490787 | 0.76 | KDM4E (0.39) | ALDH1A1L3MBTL1HTTKDM4EHPGD | |
| SCHEMBL8666981 | 0.75 | MAPT (0.39) | CYP1A2CYP2A6ALDH1A1L3MBTL1SLC6A2 | |
| SCHEMBL8665969 | 0.73 | CYP2A6 (0.43) | CYP1A2CYP2A6ALDH1A1L3MBTL1TNKS | |
| SCHEMBL2689653 | 0.72 | WDR5 (0.37) | CYP1A2CYP2A6ALDH1A1L3MBTL1SLC6A2 | |
| SCHEMBL11594968 | 0.72 | ALDH1A1 (0.34) | CYP1A2ALDH1A1L3MBTL1HTTHPGD | |
| SCHEMBL8667128 | 0.70 | CYP1A2 (0.40) | CYP1A2ALDH1A1L3MBTL1KDM4EHPGD | |
| SCHEMBL8663516 | 0.70 | MAPT (0.38) | CYP1A2CYP2A6ALDH1A1TNKSPARP1 |
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-5792589-A | ORGANIC BINDER; OPTICALLY CROSSLINKABLE COMPOUND; RADICAL-GENERATING AGENT: 2,4,5-TRIARYL IMIDAZOLE DIMER, AMINO-GROUP CONTAINING BENZOPHENONE PHOTOSENSITIZER, A THIOL COMPOUND | JAPAN SYNTHETIC RUBBER CO., LTD. (JP) | 1998-08-11 | — | — | US | disclosed |