Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 2/20 | 0.47 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.46 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.46 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.46 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MLYCD | O95822 | 1/20 | 0.42 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.41 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL23470999 | 0.88 | HDAC3 (0.41) | MMP13ROCK2HDAC3HDAC4HDAC1 | |
| SCHEMBL21015964 | 0.86 | NR1H4 (0.44) | MMP13ROCK2HDAC6HPGDLMNA | |
| SCHEMBL23471006 | 0.85 | HDAC3 (0.39) | MMP13ROCK2HDAC3HDAC4HDAC1 | |
| SCHEMBL23470986 | 0.84 | SPR (0.50) | MMP13ROCK2HDAC3HDAC4HDAC1 | |
| SCHEMBL19634729 | 0.84 | HDAC3 (0.47) | MMP13ROCK2HDAC3HDAC4HDAC1 | |
| SCHEMBL23471106 | 0.84 | HDAC1 (0.55) | HDAC3HDAC4HDAC1HDAC2HDAC11 | |
| SCHEMBL23470988 | 0.83 | HDAC3 (0.46) | MMP13HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL23471101 | 0.83 | HDAC3 (0.46) | MMP13ROCK2HDAC3HDAC4HDAC1 | |
| SCHEMBL21015960 | 0.83 | ROCK2 (0.42) | MMP13ROCK2HDAC6HPGDLMNA | |
| SCHEMBL23471264 | 0.82 | HDAC3 (0.48) | HDAC3HDAC4HDAC1HDAC7HDAC2 |
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 |