Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 4/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8665969 | 0.81 | CYP2A6 (0.43) | CYP2A6CYP1A2MAPTRAB9ALMNA | |
| SCHEMBL8666425 | 0.81 | POLB (0.37) | CYP2A6CYP1A2MAPTRAB9ALMNA | |
| SCHEMBL8666337 | 0.81 | HPRT1 (0.36) | CYP2A6CYP1A2MAPTRAB9ALMNA | |
| SCHEMBL8666379 | 0.79 | CYP2A6 (0.34) | CYP2A6CYP1A2MAPTRAB9ALMNA | |
| SCHEMBL8665239 | 0.77 | MAPT (0.47) | CYP1A2MAPTRAB9ALMNASMN1; SMN2 | |
| SCHEMBL8666981 | 0.76 | MAPT (0.39) | CYP2A6CYP1A2MAPTRAB9ALMNA | |
| SCHEMBL8665295 | 0.73 | CYP2A6 (0.45) | CYP2A6CYP1A2MAPTLMNAALDH1A1 | |
| SCHEMBL2689653 | 0.73 | WDR5 (0.37) | CYP2A6CYP1A2MAPTRAB9ALMNA | |
| SCHEMBL2494110 | 0.73 | PTGS1 (0.37) | CYP2A6CYP1A2RAB9ALMNASMN1; SMN2 | |
| SCHEMBL8667184 | 0.71 | CYP1A2 (0.38) | CYP2A6CYP1A2MAPTLMNARECQL |
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 |