Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 10/20 | 0.43 |
| ▸ | CA12 | O43570 | 9/20 | 0.43 |
| ▸ | CA1 | P00915 | 9/20 | 0.43 |
| ▸ | CA9 | Q16790 | 8/20 | 0.43 |
| ▸ | CA3 | P07451 | 6/20 | 0.43 |
| ▸ | CA6 | P23280 | 6/20 | 0.43 |
| ▸ | CA7 | P43166 | 6/20 | 0.43 |
| ▸ | CA13 | Q8N1Q1 | 6/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 6/20 | 0.43 |
| ▸ | CA5A | P35218 | 5/20 | 0.43 |
| ▸ | CA5B | Q9Y2D0 | 5/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Acetanilide SCHEMBL11803715 | 0.87 | CA2 (0.42) | CISD1CA2CA12CA1CA9 | |
| Acetanilide SCHEMBL11804849 | 0.87 | CA2 (0.42) | CA2CA12CA1CA9HIF1A | |
| Aniline SCHEMBL11796628 | 0.86 | CISD1 (0.52) | CISD1CA2CA12CA1CA9 | |
| Acetanilide SCHEMBL11799186 | 0.86 | CA2 (0.41) | CA2CA12CA1CA9HIF1A | |
| Acetanilide SCHEMBL11797057 | 0.85 | CA2 (0.41) | CA2CA12CA1CA9HIF1A | |
| SCHEMBL11783802 | 0.84 | CISD1 (0.47) | CISD1CA2CA12CA1CA9 | |
| Acetanilide SCHEMBL11798856 | 0.84 | PPARG (0.41) | CA2CA12CA1CA9CA7 | |
| SCHEMBL11802086 | 0.83 | CISD1 (0.45) | CISD1CA2CA12CA1CA9 | |
| SCHEMBL11808102 | 0.82 | CA2 (0.61) | CISD1CA2CA12CA1CA9 | |
| Acetanilide SCHEMBL11800573 | 0.81 | HSD17B10 (0.46) | CA2CA12CA1CA9HSD17B10 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-3992440-A | DIURETICS | CIBA-GEIGY CORPORATION (US) | 1976-11-16 | — | — | US | disclosed |
| US-3982018-A | DIURETICS | CIBA-GEIGY CORPORATION (US) | 1976-09-21 | — | — | US | disclosed |
| US-3939267-A | DIURETIC | CIBA-GEIGY CORPORATION (US) | 1976-02-17 | — | — | US | disclosed |