Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 6/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | RARA | P10276 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | MTOR | P42345 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | ESR1 | P03372 | 2/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.45 |
| ▸ | TACR2 | P21452 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL320046 | 0.93 | CA2 (0.54) | RARBHSD17B10ALDH1A1CA2CA1 | |
| SCHEMBL5551587 | 0.89 | RARB (0.67) | RARBHSD17B10TSHRALDH1A1MEN1 | |
| SCHEMBL28829434 | 0.89 | RARB (0.67) | RARBHSD17B10TSHRALDH1A1MEN1 | |
| SCHEMBL4663409 | 0.86 | ESR1 (0.59) | RARBHSD17B10TSHRALDH1A1CA2 | |
| SCHEMBL15643365 | 0.86 | LPL (0.45) | RARBHSD17B10TSHRMAPTCA2 | |
| SCHEMBL7468095 | 0.86 | ESR1 (0.59) | RARBHSD17B10TSHRALDH1A1CA2 | |
| SCHEMBL28900119 | 0.86 | RARB (0.64) | RARBHSD17B10TSHRALDH1A1MEN1 | |
| SCHEMBL14193847 | 0.84 | ESR1 (0.63) | HSD17B10TSHRALDH1A1ESR1ADRA2A | |
| SCHEMBL282601 | 0.84 | ESR1 (0.63) | HSD17B10TSHRALDH1A1ESR1ADRA2A | |
| SCHEMBL9850855 | 0.84 | ESR1 (0.63) | HSD17B10TSHRALDH1A1ESR1ADRA2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-112939715-A | Synthesis method of 4-alkyl biphenyl acetylene | 惠泽化学科技(濮阳)有限公司 | 2021-06-11 | — | — | CN | disclosed |