Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 2/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.44 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL19634824 | 0.83 | HTT (0.52) | MMP13HDAC2HDAC8HDAC6HDAC3 | |
| SCHEMBL19634818 | 0.79 | KDM1A (0.52) | MMP13HDAC2HDAC8HDAC6HDAC3 | |
| SCHEMBL19634746 | 0.77 | MMP13 (0.49) | MMP13HDAC2HDAC8HDAC6HDAC3 | |
| SCHEMBL19634740 | 0.76 | LOXL2 (0.64) | MMP13HDAC2HDAC8HDAC6HDAC3 | |
| SCHEMBL19634801 | 0.76 | SLC7A5 (0.58) | MMP13HDAC2HDAC8HDAC6HDAC3 | |
| SCHEMBL16380331 | 0.75 | ROCK2 (0.53) | MMP13HDAC2HDAC8HDAC6HDAC3 | |
| SCHEMBL8646446 | 0.74 | HDAC1 (0.57) | MMP13HDAC2HDAC8HDAC6HDAC3 | |
| SCHEMBL19634816 | 0.73 | ROCK2 (0.57) | MMP13HDAC2HDAC8HDAC6HDAC3 | |
| SCHEMBL3530258 | 0.72 | KMT2A (0.64) | MMP13HDAC2HDAC8HDAC6HDAC3 | |
| SCHEMBL19634802 | 0.72 | PARP1 (0.53) | MMP13HDAC2HDAC8HDAC6HDAC3 |
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 |