Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL9245383 | 0.76 | TSHR (0.47) | ALDH1A1HSD17B10TSHRTDP1CYP3A4 | |
| SCHEMBL11212020 | 0.74 | TSHR (0.45) | ALDH1A1HSD17B10TSHRTDP1CYP3A4 | |
| SCHEMBL10493511 | 0.73 | TP53 (0.48) | ALDH1A1HSD17B10TSHRTDP1TP53 | |
| SCHEMBL10902473 | 0.71 | — | — | |
| Potassium Ion SCHEMBL10882278 | 0.71 | ALDH1A1 (0.42) | ALDH1A1HSD17B10TSHRTDP1CYP3A4 | |
| Potassium SCHEMBL11446243 | 0.71 | ALDH1A1 (0.42) | ALDH1A1HSD17B10TSHRTDP1CYP3A4 | |
| SCHEMBL10668390 | 0.69 | ALDH1A1 (0.30) | ALDH1A1HSD17B10TSHR | |
| SCHEMBL11853498 | 0.68 | — | — | |
| SCHEMBL3822279 | 0.68 | ALDH1A1 (0.41) | ALDH1A1HSD17B10TSHRTDP1TP53 | |
| SCHEMBL11525057 | 0.68 | TDP1 (0.37) | ALDH1A1HSD17B10TSHRTDP1TP53 |
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-4150124-A | INSECTICIDES, MITICIDES, FUNGICIDES | CELAMERCK GMBH & CO. KG (DE) | 1979-04-17 | — | — | US | disclosed |