Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 5/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.35 |
| ▸ | HTR2A | P28223 | 2/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.34 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.34 |
| ▸ | ATR | Q13535 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | MITF | O75030 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18908830 | 0.81 | SMN1; SMN2 (0.36) | HSD17B10GABRG2GABRB3GABRA5ALDH1A1 | |
| SCHEMBL18908828 | 0.81 | HSD17B10 (0.36) | HSD17B10GABRG2GABRB3GABRA5ALDH1A1 | |
| SCHEMBL19454394 | 0.81 | NPC1 (0.42) | HSD17B10ALDH1A1MAPK1HPGDATR | |
| SCHEMBL24259877 | 0.79 | HSD17B10 (0.33) | HSD17B10GABRG2GABRB3GABRA5ALDH1A1 | |
| SCHEMBL30189427 | 0.75 | CYP2A6 (0.43) | HSD17B10GABRG2GABRB3GABRA5ALDH1A1 | |
| SCHEMBL19454399 | 0.74 | HSD17B10 (0.36) | HSD17B10GABRG2GABRB3GABRA5ALDH1A1 | |
| SCHEMBL19404449 | 0.74 | HSD17B10 (0.36) | HSD17B10GABRG2GABRB3GABRA5ALDH1A1 | |
| SCHEMBL19404374 | 0.74 | HSD17B10 (0.39) | HSD17B10GABRG2GABRB3GABRA5ALDH1A1 | |
| SCHEMBL19404381 | 0.74 | HSD17B10 (0.36) | HSD17B10GABRG2GABRB3GABRA5ALDH1A1 | |
| SCHEMBL18908812 | 0.74 | ALDH1A1 (0.36) | HSD17B10GABRG2GABRB3GABRA5ALDH1A1 |
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-3424905-B1 | HETEROCYCLIC COMPOUND | SUMITOMO CHEMICAL CO (JP) | 2021-08-04 | — | — | EP | disclosed |