Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 7/20 | 0.39 |
| ▸ | F2 | P00734 | 1/20 | 0.37 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.37 |
| ▸ | TPSD1 | Q9BZJ3 | 1/20 | 0.37 |
| ▸ | TPSG1 | Q9NRR2 | 1/20 | 0.37 |
| ▸ | KDM1A | O60341 | 5/20 | 0.36 |
| ▸ | PRMT5 | O14744 | 2/20 | 0.34 |
| ▸ | WDR77 | Q9BQA1 | 2/20 | 0.34 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.33 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.32 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TAAR1 | Q96RJ0 | 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 | |
|---|---|---|---|---|
| SCHEMBL19086176 | 0.71 | KDM1A (0.51) | HDAC6F2TPSAB1TPSD1TPSG1 | |
| SCHEMBL17544835 | 0.70 | HDAC6 (0.42) | HDAC6F2TPSAB1TPSD1TPSG1 | |
| SCHEMBL19086200 | 0.69 | HDAC6 (0.48) | HDAC6KDM1APRMT5WDR77MEN1 | |
| SCHEMBL28956427 | 0.65 | HDAC6 (0.41) | HDAC6F2TPSAB1TPSD1TPSG1 | |
| SCHEMBL19086224 | 0.65 | HDAC6 (0.42) | HDAC6KDM1AMEN1KMT2ADPP8 | |
| SCHEMBL3441635 | 0.64 | HDAC6 (0.43) | HDAC6F2TPSAB1TPSD1TPSG1 | |
| Hydrochloric Acid SCHEMBL27170981 | 0.64 | DPP8 (0.62) | MEN1KMT2ADPP8DPP7KDM4E | |
| SCHEMBL3555661 | 0.63 | NOTUM (0.47) | HDAC6F2TPSAB1TPSD1TPSG1 | |
| SCHEMBL19303081 | 0.62 | ESR2 (0.52) | HDAC6KDM4E | |
| SCHEMBL2921885 | 0.62 | MAPT (0.44) | HDAC6F2TPSAB1TPSD1TPSG1 |
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-2017195216-A1 | CYCLOPROPYL-AMIDE COMPOUNDS AS DUAL LSD1/HDAC INHIBITORS | JUBILANT BIOSYS LIMITED (IN) | 2017-11-16 | — | — | WO | disclosed |