Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 4/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 3/20 | 0.31 |
| ▸ | TNNC1 | P63316 | 5/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.31 |
| ▸ | SGPL1 | O95470 | 1/20 | 0.31 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.31 |
| ▸ | GPR183 | P32249 | 1/20 | 0.31 |
| ▸ | CERS2 | Q96G23 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21191853 | 1.00 | ESR1 (0.42) | ESR1HDAC1HDAC11HDAC8HDAC6 | |
| SCHEMBL14406535 | 1.00 | ESR1 (0.42) | ESR1HDAC1HDAC11HDAC8HDAC6 | |
| SCHEMBL19424088 | 0.97 | ESR1 (0.41) | ESR1HDAC1HDAC11HDAC8HDAC6 | |
| SCHEMBL19204390 | 0.97 | ESR1 (0.41) | ESR1HDAC1HDAC11HDAC8HDAC6 | |
| SCHEMBL9557621 | 0.97 | ESR1 (0.41) | ESR1HDAC1HDAC11HDAC8HDAC6 | |
| SCHEMBL9557316 | 0.97 | ESR1 (0.41) | ESR1HDAC1HDAC11HDAC8HDAC6 | |
| SCHEMBL18542125 | 0.97 | ESR1 (0.41) | ESR1HDAC1HDAC11HDAC8HDAC6 | |
| SCHEMBL21191577 | 0.97 | ESR1 (0.41) | ESR1HDAC1HDAC11HDAC8HDAC6 | |
| SCHEMBL18542136 | 0.97 | ESR1 (0.41) | ESR1HDAC1HDAC11HDAC8HDAC6 | |
| SCHEMBL18949946 | 0.95 | ESR1 (0.40) | ESR1HDAC1HDAC11HDAC8HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2457908-A1 | Process for the Preparation of Compounds useful as inhibitors of SGLT | Janssen Pharmaceutica N.V. (BE) | 2012-05-30 | — | — | EP | disclosed |