Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC2 | Q92769 | 1/20 | 0.55 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.55 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL19634725 | 0.88 | HSD17B10 (0.50) | MAPTPOLBCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL19634412 | 0.85 | HDAC6 (0.53) | HDAC2HDAC8HDAC6ALDH1A1LMNA | |
| SCHEMBL19634461 | 0.84 | HDAC6 (0.55) | HDAC2HDAC8HDAC6ALDH1A1LMNA | |
| Hydrochloric Acid SCHEMBL2464026 | 0.83 | ALDH1A1 (0.70) | HDAC2HDAC8HDAC6ALDH1A1NPSR1 | |
| SCHEMBL19634394 | 0.83 | CYP1A2 (0.70) | HDAC2HDAC8HDAC6ALDH1A1NPSR1 | |
| SCHEMBL8404689 | 0.82 | ACKR3 (0.56) | HDAC2HDAC8HDAC6ALDH1A1LMNA | |
| SCHEMBL19634690 | 0.81 | ALDH1A1 (0.52) | HDAC2HDAC8HDAC6ALDH1A1NPSR1 | |
| SCHEMBL8404675 | 0.81 | CD274 (0.71) | ALDH1A1POLBCYP1A2CYP2D6CD274 | |
| SCHEMBL19634691 | 0.81 | HASPIN (0.62) | HDAC2HDAC8HDAC6ALDH1A1GAA | |
| SCHEMBL23840591 | 0.77 | HDAC6 (0.69) | HDAC2HDAC8HDAC6ALDH1A1LMNA |
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-2017200984-A1 | NOVEL CYCLOSPORIN DERIVATIVES AND USES THEREOF | S&T GLOBAL INC. (US) | 2017-11-23 | — | — | WO | disclosed |