Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CISD1 | Q9NZ45 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | CA6 | P23280 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | CA5A | P35218 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11838989 | 0.88 | MEN1 (0.39) | CISD1MEN1KMT2ACYP2C9CYP3A4 | |
| SCHEMBL11788087 | 0.86 | CISD1 (0.53) | CISD1CYP2C9CA12ALDH1A1CA1 | |
| SCHEMBL11781753 | 0.82 | CISD1 (0.41) | CISD1HDAC3HDAC1HDAC2NCOR2 | |
| SCHEMBL11802842 | 0.81 | CISD1 (0.47) | CISD1CA12ALDH1A1CA1CA2 | |
| SCHEMBL11796943 | 0.77 | BRAF (0.37) | CISD1MEN1KMT2AAPP | |
| SCHEMBL11705514 | 0.75 | CISD1 (0.67) | CISD1MEN1KMT2ACYP2C9CA12 | |
| SCHEMBL11777537 | 0.72 | CISD1 (0.40) | CISD1MEN1KMT2ACA12ALDH1A1 | |
| Aniline SCHEMBL11799081 | 0.71 | CISD1 (0.53) | CISD1CYP2C9CA12ALDH1A1CA1 | |
| SCHEMBL11843466 | 0.71 | ALDH1A1 (0.52) | CISD1MEN1KMT2AHDAC3HDAC1 | |
| SCHEMBL11790756 | 0.71 | CISD1 (0.58) | CISD1CYP2C9CA12ALDH1A1CA1 |
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-3939267-A | DIURETIC | CIBA-GEIGY CORPORATION (US) | 1976-02-17 | — | — | US | disclosed |