Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.54 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.50 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.48 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.48 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | RARA | P10276 | 1/20 | 0.44 |
| ▸ | RARB | P10826 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | XDH | P47989 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.43 |
| ▸ | PPARD | Q03181 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1547853 | 0.84 | NQO1 (0.56) | NQO1CHRNA7FFAR1FFAR4TSHR | |
| SCHEMBL8767150 | 0.82 | CHRNA7 (0.41) | NQO1CHRNA7FFAR1FFAR4CYP11B1 | |
| SCHEMBL18310399 | 0.81 | FFAR1 (0.50) | NQO1FFAR1FFAR4CYP11B1CYP11B2 | |
| SCHEMBL9155582 | 0.81 | NQO1 (0.82) | NQO1TSHRTDP1ALDH1A1KDM4E | |
| SCHEMBL5833291 | 0.81 | NQO1 (0.82) | NQO1TSHRTDP1ALDH1A1KDM4E | |
| SCHEMBL18417193 | 0.81 | NQO1 (0.82) | NQO1TSHRTDP1ALDH1A1KDM4E | |
| SCHEMBL5071281 | 0.80 | RARB (0.48) | FFAR1FFAR4CYP11B1CYP11B2RARA | |
| SCHEMBL7247955 | 0.80 | ERN1 (0.57) | NQO1CHRNA7FFAR1FFAR4ALDH1A1 | |
| SCHEMBL19801798 | 0.80 | CYP11B1 (0.71) | CYP11B1CYP11B2 | |
| SCHEMBL7907955 | 0.80 | GPR84 (0.42) | NQO1CHRNA7FFAR1FFAR4ALDH1A1 |
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-0438575-A1 | BENZOL DERIVATIVES AND LIQUID CRYSTALLINE MEDIUM. | MERCK PATENT GMBH (DE) | 1991-07-31 | — | — | EP | disclosed |