Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | DNMT1 | P26358 | 3/20 | 0.36 |
| ▸ | CA9 | Q16790 | 3/20 | 0.35 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.35 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.35 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.35 |
| ▸ | TNF | P01375 | 1/20 | 0.32 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4473163 | 0.91 | MCL1 (0.39) | MCL1DNMT1CA9CA12CA1 | |
| SCHEMBL13708551 | 0.85 | MCL1 (0.34) | MCL1DNMT1CA9CA12CA1 | |
| SCHEMBL6233172 | 0.85 | PIN1 (0.38) | MCL1DNMT1ALDH1A1TNFHPGD | |
| SCHEMBL20000837 | 0.84 | NPC1 (0.38) | CA9CA12CA1ALDH1A1NPC1 | |
| SCHEMBL4466533 | 0.83 | TNF (0.32) | MCL1DNMT1CA9CA12CA1 | |
| SCHEMBL4469438 | 0.82 | ALDH1A1 (0.40) | MCL1DNMT1CA9CA12CA1 | |
| SCHEMBL4466929 | 0.81 | DNMT1 (0.38) | MCL1DNMT1CA9CA12CA1 | |
| SCHEMBL4470665 | 0.80 | CTDSP1 (0.41) | ALDH1A1ANXA2S100A10TP53 | |
| SCHEMBL20000836 | 0.80 | POLB (0.34) | ALDH1A1NPC1RAB9AL3MBTL1MDM2 | |
| SCHEMBL20000838 | 0.80 | KCNA5 (0.42) | ALDH1A1KCNA5HPGDMDM2 |
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-2018058109-A1 | COMPOSITIONS AND METHODS FOR TREATING METABOLIC DISORDERS | NUSIRT SCIENCES, INC. (US) | 2018-03-29 | — | — | WO | disclosed |