Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.40 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 3/20 | 0.37 |
| ▸ | AHR | P35869 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | ALOX15B | O15296 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | HTR3A | P46098 | 1/20 | 0.35 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8138970 | 0.98 | KMT2A (0.40) | HSD17B10AKR1C3AKR1C1POLBMEN1 | |
| SCHEMBL1119465 | 0.91 | HSD17B10 (0.44) | HSD17B10AKR1C3AKR1C1MEN1MAPK1 | |
| SCHEMBL6002534 | 0.81 | HTR3A (0.44) | HSD17B10CYP1A2HTR3ANPC1RAB9A | |
| SCHEMBL19616105 | 0.78 | MAOB (0.36) | HSD17B10AKR1C3MAOBAHR | |
| SCHEMBL652509 | 0.77 | NPC1 (0.42) | KMT2AMAOBLMNAALDH1A1NPC1 | |
| SCHEMBL493565 | 0.77 | CNR1 (0.40) | HSD17B10MAOBNPC1RAB9A | |
| SCHEMBL316481 | 0.76 | POLB (0.45) | POLBMAPK1MAOBKDM4E | |
| SCHEMBL7055107 | 0.76 | TRPM8 (0.44) | POLBKMT2AMAOBCYP2A6ALDH1A1 | |
| SCHEMBL8227101 | 0.75 | ALDH1A1 (0.45) | MEN1MAPK1KMT2ALMNAALDH1A1 | |
| SCHEMBL1119493 | 0.74 | POLB (0.44) | POLBMAPK1MAOBKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-4470991-A | Benzothiazolesulfonamide derivatives for the topical treatment of elevated intraocular pressure | MERCK & CO., INC. (US) | 1984-09-11 | — | — | US | disclosed |