Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 2/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | AR | P10275 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.39 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | IKBKB | O14920 | 1/20 | 0.39 |
| ▸ | HNF4A | P41235 | 1/20 | 0.39 |
| ▸ | APEX1 | P27695 | 3/20 | 0.39 |
| ▸ | MYC | P01106 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31591514 | 0.87 | POLB (0.50) | EGFRKDRNR1H4MAPK1KDM4E | |
| SCHEMBL27524850 | 0.83 | IKBKB (0.56) | NR1H4HSD17B10MAPK1KDM4EALDH1A1 | |
| SCHEMBL30394743 | 0.82 | HNF4A (0.58) | ERN1NR1H4HSD17B10MAPK1KDM4E | |
| SCHEMBL4632581 | 0.82 | HNF4A (0.58) | ERN1NR1H4HSD17B10MAPK1KDM4E | |
| SCHEMBL17799595 | 0.81 | HNF4A (0.56) | ERN1NR1H4HSD17B10MAPK1KDM4E | |
| SCHEMBL10945970 | 0.80 | ALDH1A1 (0.49) | NR1H4HSD17B10MAPK1KDM4EALDH1A1 | |
| SCHEMBL13734618 | 0.79 | ERN1 (0.51) | ERN1HSD17B10ARKDM4EALDH1A1 | |
| SCHEMBL8108581 | 0.78 | ERN1 (0.48) | ERN1HSD17B10ARKDM4EALDH1A1 | |
| SCHEMBL15265076 | 0.77 | SLC6A4 (0.56) | NR1H4MAPK1KDM4EHNF4AGAA | |
| SCHEMBL39857 | 0.76 | ALDH1A1 (0.55) | HSD17B10MAPK1KDM4EALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-2152719-A1 | BICYCLIC HETEROAROMATIC COMPOUNDS AS INHIBITORS OF STEAROYL-COENZYME A DELTA-9 DESATURASE | Merck Frosst Canada Ltd. (CA) | 2010-02-17 | — | — | EP | disclosed |
| WO-2008141455-A1 | BICYCLIC HETEROAROMATIC COMPOUNDS AS INHIBITORS OF STEAROYL-COENZYME A DELTA-9 DESATURASE | MERCK FROSST CANADA LTD. (CA) | 2008-11-27 | — | — | WO | disclosed |