Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 9/20 | 1.00 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.54 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11016994 | 0.77 | CA2 (0.62) | CA2AKR1B1KDM4EALDH1A1GAA | |
| SCHEMBL10573479 | 0.73 | CA2 (0.66) | CA2CA12CA9 | |
| SCHEMBL4450283 | 0.71 | AKR1B1 (1.00) | CA2AKR1B1 | |
| SCHEMBL16821915 | 0.70 | CA2 (0.54) | CA2AKR1B1KDM4EALDH1A1RAB9A | |
| SCHEMBL7493903 | 0.69 | CA2 (0.53) | CA2AKR1B1KDM4EALDH1A1GAA | |
| SCHEMBL2400125 | 0.68 | GPR35 (0.56) | CA2AKR1B1KDM4EALDH1A1RAB9A | |
| SCHEMBL13850474 | 0.68 | CA2 (0.51) | CA2AKR1B1KDM4EALDH1A1GAA | |
| SCHEMBL30817138 | 0.68 | GPR35 (0.56) | CA2AKR1B1KDM4EALDH1A1RAB9A | |
| SCHEMBL10573193 | 0.68 | CA2 (0.62) | CA2CA12CA9KDM4EALDH1A1 | |
| SCHEMBL8980508 | 0.67 | AKR1B1 (0.51) | CA2AKR1B1CA12CA9KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4840963-A | FOR GLAUCOMA | MERCK & CO., INC. (US) | 1989-06-20 | — | — | US | disclosed |
| EP-0155214-A2 | 2-sulfamoyl-1H-indole derivatives for the treatment of elevated intraocular pressure | MERCK & CO. INC. (US) | 1985-09-18 | — | — | EP | disclosed |