Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.58 |
| ▸ | NPC1 | O15118 | 4/20 | 0.58 |
| ▸ | RAB9A | P51151 | 4/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.58 |
| ▸ | HPGD | P15428 | 2/20 | 0.58 |
| ▸ | KLK7 | P49862 | 1/20 | 0.58 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.56 |
| ▸ | SCD | O00767 | 3/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | ATM | Q13315 | 1/20 | 0.55 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.55 |
| ▸ | BLM | P54132 | 1/20 | 0.54 |
| ▸ | LCK | P06239 | 1/20 | 0.54 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL29947717 | 1.00 | HSD17B10 (0.63) | HSD17B10SMN1; SMN2NPC1RAB9AALDH1A1 | |
| SCHEMBL14807662 | 0.86 | MAP3K5 (0.70) | HSD17B10SMN1; SMN2NPC1RAB9AALDH1A1 | |
| SCHEMBL29947460 | 0.86 | HSD17B10 (0.73) | HSD17B10SMN1; SMN2NPC1RAB9AALDH1A1 | |
| SCHEMBL24729341 | 0.86 | HSD17B10 (0.73) | HSD17B10SMN1; SMN2NPC1RAB9AALDH1A1 | |
| SCHEMBL29947557 | 0.85 | HSD17B10 (0.63) | HSD17B10SMN1; SMN2NPC1RAB9AALDH1A1 | |
| SCHEMBL24729250 | 0.85 | HSD17B10 (0.63) | HSD17B10SMN1; SMN2NPC1RAB9AALDH1A1 | |
| SCHEMBL23926531 | 0.85 | NPC1 (0.61) | SMN1; SMN2NPC1RAB9AALDH1A1KDM4E | |
| SCHEMBL24729330 | 0.85 | HSD17B10 (0.57) | HSD17B10SMN1; SMN2NPC1RAB9AALDH1A1 | |
| SCHEMBL29947738 | 0.85 | HSD17B10 (0.57) | HSD17B10SMN1; SMN2NPC1RAB9AALDH1A1 | |
| SCHEMBL24729560 | 0.85 | HSD17B10 (0.65) | HSD17B10SMN1; SMN2NPC1RAB9AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022240213-A1 | NOVEL BENZOTHIAZOLE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF FOR PREVENTION OR TREATMENT OF LIVER DISEASE | 에이치케이이노엔 주식회사 | 2022-11-17 | — | — | WO | disclosed |