Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | CA12 | O43570 | 4/20 | 0.51 |
| ▸ | CA1 | P00915 | 4/20 | 0.51 |
| ▸ | CA2 | P00918 | 4/20 | 0.51 |
| ▸ | CA7 | P43166 | 4/20 | 0.51 |
| ▸ | CA9 | Q16790 | 4/20 | 0.51 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.51 |
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.43 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1980259 | 0.88 | TSHR (0.53) | TSHRCA12CA1CA2CA7 | |
| SCHEMBL2903968 | 0.86 | TSHR (0.52) | TSHRCA12CA1CA2CA7 | |
| SCHEMBL18468247 | 0.86 | TSHR (0.55) | TSHRCA12CA1CA2CA7 | |
| SCHEMBL6160953 | 0.84 | TSHR (0.53) | TSHRCA12CA1CA2CA7 | |
| SCHEMBL21487957 | 0.83 | MEN1 (0.53) | TSHRCA12CA1CA2CA7 | |
| SCHEMBL23941175 | 0.82 | TSHR (0.55) | TSHRCA12CA1CA2CA7 | |
| SCHEMBL979279 | 0.82 | CA1 (0.46) | TSHRCA12CA1CA2CA7 | |
| SCHEMBL30798535 | 0.81 | TSHR (0.50) | TSHRCA12CA1CA2CA7 | |
| SCHEMBL24718020 | 0.81 | TSHR (0.50) | TSHRCA12CA1CA2CA7 | |
| SCHEMBL9304224 | 0.80 | MAPT (0.51) | TSHRCA12CA1CA2CA7 |
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-5329041-A | For herbicides | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1994-07-12 | — | — | US | disclosed |
| WO-1992012957-A1 | TRISUBSTITUTED BENZOIC ACID INTERMEDIATES | NGUYEN NHAN H (US) | 1992-08-06 | — | — | WO | disclosed |