Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 8/20 | 0.68 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.68 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.62 |
| ▸ | HDAC2 | Q92769 | 6/20 | 0.61 |
| ▸ | HDAC3 | O15379 | 6/20 | 0.61 |
| ▸ | POLB | P06746 | 2/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | MAPT | P10636 | 1/20 | 0.61 |
| ▸ | RAB9A | P51151 | 1/20 | 0.61 |
| ▸ | HDAC8 | Q9BY41 | 6/20 | 0.57 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.57 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.57 |
| ▸ | EPHX2 | P34913 | 5/20 | 0.53 |
| ▸ | NR1H4 | Q96RI1 | 4/20 | 0.53 |
| ▸ | MMP13 | P45452 | 1/20 | 0.53 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL13366944 | 0.85 | MMP13 (0.54) | HDAC1HDAC6HDAC2HDAC3POLB | |
| SCHEMBL5592606 | 0.85 | HDAC6 (0.54) | HDAC1HDAC6HDAC2HDAC3POLB | |
| SCHEMBL19634441 | 0.84 | HDAC1 (0.64) | HDAC1HDAC6KMT2AHDAC2HDAC3 | |
| SCHEMBL12368427 | 0.83 | HDAC1 (0.72) | HDAC1HDAC6KMT2AHDAC2HDAC3 | |
| SCHEMBL23470991 | 0.83 | HDAC1 (0.62) | HDAC1HDAC6KMT2AHDAC2HDAC3 | |
| SCHEMBL19634449 | 0.83 | HDAC6 (0.70) | HDAC1HDAC6KMT2AHDAC3RAB9A | |
| SCHEMBL620074 | 0.82 | POLB (0.66) | HDAC6KMT2APOLBALDH1A1HDAC4 | |
| SCHEMBL16380331 | 0.81 | ROCK2 (0.53) | HDAC1HDAC6HDAC2HDAC3POLB | |
| SCHEMBL19634403 | 0.81 | HDAC1 (0.60) | HDAC1HDAC6KMT2AHDAC2HDAC3 | |
| SCHEMBL25686649 | 0.81 | EPHX2 (0.71) | HDAC1HDAC6KMT2AHDAC2HDAC3 |
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 |