Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 6/20 | 0.53 |
| ▸ | LIG1 | P18858 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | USP2 | O75604 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 3/20 | 0.41 |
| ▸ | CA9 | Q16790 | 3/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11053655 | 0.77 | STS (0.45) | CA2LIG1LMNAMAPTHPGD | |
| SCHEMBL11723057 | 0.74 | MEN1 (0.43) | CA2LMNAMAPTHPGDESR2 | |
| SCHEMBL3585261 | 0.73 | CA2 (0.42) | CA2LMNAMAPTESR2MEN1 | |
| SCHEMBL4977235 | 0.69 | CA2 (0.41) | CA2CA1CA9CA12MAPK1 | |
| SCHEMBL2200875 | 0.69 | CA1 (0.37) | CA2LMNAMAPTPKMHTT | |
| SCHEMBL1559973 | 0.69 | GSK3B (0.38) | CA2LMNAMAPTMEN1KMT2A | |
| SCHEMBL10493783 | 0.69 | ALDH1A1 (0.38) | CA2LMNAMAPTHPGDMEN1 | |
| SCHEMBL10368300 | 0.69 | CA2 (1.00) | CA2LMNAMAPTHPGDESR1 | |
| SCHEMBL23531735 | 0.68 | PTK2 (0.36) | CA2LMNAMAPTESR2MEN1 | |
| SCHEMBL9389349 | 0.68 | CA2 (0.57) | CA2LMNAMAPTHPGDESR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0268396-B1 | 4-(BENZOYL)THIOPHENE(OR FURAN)-SULFONAMIDE AND DERIVATIVES THEREOF FOR THE TOPICAL TREATMENT OF ELEVATED INTRAOCULAR PRESSURES | MERCK & CO. INC. (US) | 1990-11-28 | — | — | EP | disclosed |
| EP-0268396-A1 | 4-(benzoyl)thiophene(or furan)-sulfonamide and derivatives thereof for the topical treatment of elevated intraocular pressures | MERCK & CO. INC. (US) | 1988-05-25 | — | — | EP | disclosed |