Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.66 |
| ▸ | TSHR | P16473 | 4/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28107116 | 0.89 | ALDH1A1 (0.51) | ALDH1A1TSHRCYP3A4TP53 | |
| Isobutane SCHEMBL11145297 | 0.83 | ALDH1A1 (0.89) | ALDH1A1TSHRCYP3A4TP53THRB | |
| SCHEMBL6933726 | 0.81 | ALDH1A1 (0.86) | ALDH1A1TSHRCYP3A4TP53THRB | |
| Propane SCHEMBL11143722 | 0.81 | ALDH1A1 (0.93) | ALDH1A1TSHRCYP3A4TP53THRB | |
| SCHEMBL28273631 | 0.81 | TSHR (0.44) | ALDH1A1TSHRTHRB | |
| SCHEMBL14873 | 0.81 | TSHR (0.44) | ALDH1A1TSHRTHRB | |
| SCHEMBL15617 | 0.81 | ALDH1A1 (1.00) | ALDH1A1TSHRCYP3A4TP53THRB | |
| SCHEMBL5098181 | 0.81 | ALDH1A1 (1.00) | ALDH1A1TSHRCYP3A4TP53THRB | |
| SCHEMBL5098171 | 0.81 | ALDH1A1 (1.00) | ALDH1A1TSHRCYP3A4TP53THRB | |
| SCHEMBL2048901 | 0.81 | ALDH1A1 (1.00) | ALDH1A1TSHRCYP3A4TP53THRB |
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-5045210-A | Synthetic Polymer Modified Polysaccharide, Ion Exchange Resins | CUNO, INCORPORATED (US) | 1991-09-03 | — | — | US | disclosed |
| WO-1990011825-A1 | HEAVY METAL REMOVAL FILTERS | CUNO, INCORPORATED (US) | 1990-10-18 | — | — | WO | disclosed |