Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.69 |
| ▸ | ESR1 | P03372 | 2/20 | 0.61 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.61 |
| ▸ | CA12 | O43570 | 3/20 | 0.54 |
| ▸ | CA1 | P00915 | 3/20 | 0.54 |
| ▸ | CA2 | P00918 | 3/20 | 0.54 |
| ▸ | CA7 | P43166 | 3/20 | 0.54 |
| ▸ | CA9 | Q16790 | 3/20 | 0.54 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.50 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.50 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.49 |
| ▸ | ACR | P10323 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | ALPL | P05186 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7615928 | 0.88 | ESR1 (0.75) | SLC6A3ESR1ESR2CA12CA1 | |
| SCHEMBL2879356 | 0.85 | SLC6A3 (0.69) | SLC6A3HSD17B10TSHRMAPTKMT2A | |
| SCHEMBL5695895 | 0.84 | SLC6A3 (0.72) | SLC6A3ESR1ESR2HSD17B10TSHR | |
| SCHEMBL2946505 | 0.84 | SLC6A3 (0.68) | SLC6A3HSD17B10TSHRMAPTKMT2A | |
| SCHEMBL27375218 | 0.84 | SLC6A3 (0.68) | SLC6A3ESR1ESR2HSD17B10TSHR | |
| SCHEMBL30373246 | 0.82 | SLC6A3 (1.00) | SLC6A3ESR1ESR2HSD17B10TSHR | |
| SCHEMBL2284514 | 0.82 | SLC6A3 (1.00) | SLC6A3ESR1ESR2HSD17B10TSHR | |
| SCHEMBL10534799 | 0.81 | ESR1 (0.65) | SLC6A3ESR1ESR2MAPTKMT2A | |
| SCHEMBL7615922 | 0.81 | SLC6A3 (0.79) | SLC6A3ESR1ESR2CA12CA1 | |
| SCHEMBL13893798 | 0.81 | CA12 (0.61) | SLC6A3ESR1CA12CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010043866-A2 | HISTONE LYSINE DEMETHYLASE INHIBITORS | ISIS INNOVATION LIMITED (GB) | 2010-04-22 | — | — | WO | disclosed |