Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 8/20 | 0.62 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | HDAC2 | Q92769 | 6/20 | 0.54 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.52 |
| ▸ | NR1H4 | Q96RI1 | 4/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.50 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.50 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.50 |
| ▸ | LSS | P48449 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL23471124 | 0.85 | HDAC1 (0.59) | HDAC1HDAC6KMT2AHDAC2HDAC3 | |
| SCHEMBL21015485 | 0.84 | HDAC6 (0.65) | HDAC1HDAC6KMT2AHDAC3ALDH1A1 | |
| SCHEMBL19634746 | 0.83 | MMP13 (0.49) | HDAC1HDAC6HDAC2HDAC3ALDH1A1 | |
| SCHEMBL19634398 | 0.81 | HDAC3 (0.54) | HDAC6KMT2AHDAC3ALDH1A1MAPT | |
| SCHEMBL19634443 | 0.81 | HDAC1 (0.66) | HDAC1HDAC6KMT2AHDAC2HDAC3 | |
| SCHEMBL19634447 | 0.80 | HDAC1 (0.64) | HDAC1HDAC6KMT2AHDAC2HDAC3 | |
| SCHEMBL19682898 | 0.79 | KMT2A (0.66) | HDAC1HDAC6KMT2AHDAC2HDAC3 | |
| SCHEMBL12082778 | 0.79 | TDP1 (0.55) | HDAC1HDAC6KMT2AALDH1A1POLB | |
| SCHEMBL12368427 | 0.79 | HDAC1 (0.72) | HDAC1HDAC6KMT2AHDAC2HDAC3 | |
| SCHEMBL23470991 | 0.79 | HDAC1 (0.62) | 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 |