Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 1/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 7/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 7/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | NQO2 | P16083 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.37 |
| ▸ | TYR | P14679 | 1/20 | 0.37 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.37 |
| ▸ | JUN | P05412 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL30567454 | 0.78 | CYP1A2 (0.52) | ERN1CYP1A1CYP1B1CYP1A2NFE2L2 | |
| SCHEMBL9065566 | 0.78 | CYP1A2 (0.52) | ERN1CYP1A1CYP1B1CYP1A2NFE2L2 | |
| SCHEMBL1792533 | 0.75 | CYP1A1 (0.61) | CYP1A1CYP1B1CYP1A2NFE2L2ALDH1A1 | |
| SCHEMBL11986284 | 0.75 | ERN1 (0.44) | ERN1CYP1A1CYP1B1CYP1A2NFE2L2 | |
| SCHEMBL4025438 | 0.75 | ERN1 (0.44) | ERN1CYP1A1CYP1B1CYP1A2NFE2L2 | |
| SCHEMBL14613174 | 0.73 | ERN1 (0.67) | ERN1CYP1A1CYP1B1CYP1A2ALDH1A1 | |
| SCHEMBL16310056 | 0.73 | ERN1 (0.43) | ERN1CYP1A1CYP1B1CYP1A2NFE2L2 | |
| SCHEMBL5440523 | 0.73 | ALDH1A1 (0.43) | ERN1CYP1A1CYP1B1CYP1A2NFE2L2 | |
| SCHEMBL825091 | 0.73 | ERN1 (0.43) | ERN1CYP1A1CYP1B1CYP1A2NFE2L2 | |
| SCHEMBL5442396 | 0.73 | NFE2L2 (0.49) | ERN1CYP1A1CYP1B1CYP1A2NFE2L2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2024375-B1 | CYCLOPROPYL FUSED INDOLOBENZAZEPINE HCV NS5B INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2011-03-09 | — | — | EP | disclosed |