Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 9/20 | 0.49 |
| ▸ | ABCG2 | Q9UNQ0 | 4/20 | 0.40 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL23020076 | 0.95 | GRM5 (0.47) | GRM5ABCG2TSHRHSD17B10CLK4 | |
| SCHEMBL23020430 | 0.95 | GRM5 (0.52) | GRM5ABCG2SQORTSHRHSD17B10 | |
| SCHEMBL23020170 | 0.92 | GRM5 (0.56) | GRM5ABCG2TSHRHSD17B10CLK4 | |
| SCHEMBL23020162 | 0.91 | MEN1 (0.44) | GRM5ABCG2TSHRHSD17B10CLK4 | |
| SCHEMBL23020186 | 0.90 | GRM5 (0.55) | GRM5ABCG2TSHRHSD17B10CLK4 | |
| SCHEMBL23020185 | 0.90 | GRM5 (0.55) | GRM5ABCG2TSHRHSD17B10CLK4 | |
| SCHEMBL21098948 | 0.90 | TSHR (0.46) | TSHRHSD17B10MAPK1MEN1ALDH1A1 | |
| SCHEMBL23020309 | 0.89 | GRM5 (0.44) | GRM5ABCG2TSHRHSD17B10CLK4 | |
| SCHEMBL22652775 | 0.89 | MAPK1 (0.48) | GRM5ABCG2TSHRHSD17B10MAPK1 | |
| SCHEMBL23020172 | 0.88 | GRM5 (0.49) | GRM5SQORTGFBR1DHODH |
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-3392242-B1 | NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | LG CHEMICAL LTD (KR) | 2021-02-24 | — | — | EP | disclosed |