Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | FLT3 | P36888 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.35 |
| ▸ | ACACA | Q13085 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 3/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23760184 | 0.83 | HSD17B10 (0.39) | HPGDNPSR1LMNAFLT3HSD17B10 | |
| SCHEMBL22036673 | 0.83 | EGFR (0.45) | EGFRKDM4EALDH1A1HPGDTDP1 | |
| SCHEMBL23760117 | 0.80 | IL1R1 (0.43) | KDM4EALDH1A1HPGDHTTHSD17B10 | |
| SCHEMBL23760181 | 0.79 | L3MBTL1 (0.36) | KDM4EALDH1A1HPGDLMNAHSD17B10 | |
| SCHEMBL23760189 | 0.79 | ALDH1A1 (0.44) | KDM4EALDH1A1HPGDTDP1NPSR1 | |
| SCHEMBL23760174 | 0.78 | ALDH1A1 (0.37) | KDM4EALDH1A1TDP1HTTHSD17B10 | |
| SCHEMBL23760128 | 0.77 | ALDH1A1 (0.42) | KDM4EALDH1A1HPGDTDP1NPSR1 | |
| SCHEMBL19120274 | 0.75 | EGFR (0.40) | EGFRKDM4EALDH1A1HPGDTDP1 | |
| SCHEMBL17426601 | 0.75 | EGFR (0.49) | EGFRKDM4EALDH1A1HPGDTDP1 | |
| SCHEMBL26239605 | 0.75 | KDM4E (0.43) | EGFRKDM4EALDH1A1HPGDTDP1 |
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-3630764-B1 | HEXACYCLIC HETEROAROMATIC COMPOUNDS FOR USE IN ELEKTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2021-08-18 | — | — | EP | disclosed |