Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.58 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | MMP13 | P45452 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 4/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | BRD4 | O60885 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | ESRRB | O95718 | 1/20 | 0.47 |
| ▸ | ESRRG | P62508 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL21742487 | 0.85 | SPHK2 (0.59) | SPHK2ALDH1A1POLBHPGDNPC1 | |
| SCHEMBL23471012 | 0.83 | SPHK2 (0.58) | SPHK2SPHK1ALDH1A1MMP13POLB | |
| SCHEMBL21015330 | 0.83 | SPHK2 (0.54) | SPHK2SPHK1ALDH1A1MMP13POLB | |
| SCHEMBL16213815 | 0.83 | L3MBTL1 (0.63) | ALDH1A1POLBHPGDNPC1RAB9A | |
| SCHEMBL4693371 | 0.82 | ALDH1A1 (0.70) | SPHK2SPHK1ALDH1A1MMP13POLB | |
| SCHEMBL620074 | 0.82 | POLB (0.66) | SPHK2SPHK1ALDH1A1MMP13POLB | |
| SCHEMBL21742543 | 0.81 | ALDH1A1 (0.59) | SPHK2ALDH1A1POLBNPC1RAB9A | |
| SCHEMBL8404665 | 0.81 | PLK1 (0.61) | SPHK2SPHK1ALDH1A1MMP13POLB | |
| SCHEMBL7462679 | 0.81 | POLB (0.78) | ALDH1A1MMP13POLBHPGDNPC1 | |
| SCHEMBL6024439 | 0.79 | NPC1 (0.75) | ALDH1A1MMP13POLBHPGDNPC1 |
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 |