Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | DNTT | P04053 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Water SCHEMBL9712332 | 0.93 | TSHR (0.41) | TSHRHTTSMN1; SMN2TP53ALDH1A1 | |
| SCHEMBL8076491 | 0.78 | TP53 (0.47) | TP53ALDH1A1HPGDALOX15HSD17B10 | |
| SCHEMBL6742596 | 0.76 | TP53 (0.46) | TP53ALDH1A1HPGDALOX15HSD17B10 | |
| SCHEMBL7167062 | 0.71 | CYP1A2 (0.44) | TP53ALDH1A1HPGDALOX15HSD17B10 | |
| SCHEMBL10959669 | 0.71 | CYP1A2 (0.44) | TP53ALDH1A1HPGDALOX15HSD17B10 | |
| SCHEMBL28102875 | 0.71 | TP53 (0.40) | TP53ALDH1A1HPGDALOX15HSD17B10 | |
| SCHEMBL1036088 | 0.70 | CYP1A2 (0.46) | HTTTP53ALDH1A1HPGDALOX15 | |
| SCHEMBL11861937 | 0.69 | CYP1A2 (0.48) | TSHRTP53ALDH1A1HPGDALOX15 | |
| SCHEMBL10704088 | 0.69 | CYP1A2 (0.48) | TSHRTP53ALDH1A1HPGDALOX15 | |
| SCHEMBL28050847 | 0.68 | TP53 (0.40) | HTTTP53ALDH1A1HPGDALOX15 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5169988-A | From unsaturated methyl ketone | CIBA-GEIGY CORPORATION (US) | 1992-12-08 | — | — | US | disclosed |
| US-5132462-A | Sulfide, sulfonyl and sulfinyl compounds, agricultural use | CIBA-GEIGY CORPORATION (US) | 1992-07-21 | — | — | US | disclosed |
| US-5026899-A | Acylcylohexanediones and the oxime ethers thereof with herbicidal and plant growth regulating properties | CIBA-GEIGY CORPORATION (US) | 1991-06-25 | — | — | US | disclosed |
| US-4909835-A | Containing a sulfur substitution in position 5 | CIBA-GEIGY CORPORATION (US) | 1990-03-20 | — | — | US | disclosed |