Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 7/20 | 0.64 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.64 |
| ▸ | HPGD | P15428 | 4/20 | 0.59 |
| ▸ | NAMPT | P43490 | 1/20 | 0.59 |
| ▸ | HDAC2 | Q92769 | 6/20 | 0.58 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.58 |
| ▸ | RAB9A | P51151 | 4/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.55 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.55 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.50 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL19634403 | 0.88 | HDAC1 (0.60) | HDAC1HDAC6HPGDNAMPTHDAC2 | |
| SCHEMBL19634450 | 0.88 | HDAC1 (0.54) | HDAC1HDAC6HPGDNAMPTHDAC2 | |
| SCHEMBL19634415 | 0.84 | HDAC1 (0.68) | HDAC1HDAC6HPGDHDAC2HDAC3 | |
| SCHEMBL21016148 | 0.84 | HDAC6 (0.67) | HDAC6HPGDNAMPTHDAC3ALDH1A1 | |
| SCHEMBL19634816 | 0.82 | ROCK2 (0.57) | HDAC1HDAC6HPGDHDAC2HDAC3 | |
| SCHEMBL7445362 | 0.82 | HPGD (0.64) | HPGDNAMPTALDH1A1KMT2ARAB9A | |
| SCHEMBL2056358 | 0.82 | HPGD (0.64) | HPGDNAMPTALDH1A1KMT2ARAB9A | |
| SCHEMBL21016048 | 0.82 | HPGD (0.56) | HDAC6HPGDNAMPTALDH1A1KMT2A | |
| SCHEMBL19465880 | 0.81 | HPGD (0.62) | HPGDNAMPTALDH1A1KMT2ARAB9A | |
| SCHEMBL9229365 | 0.81 | ALDH1A1 (0.67) | HPGDNAMPTALDH1A1KMT2ARAB9A |
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 |