Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.62 |
| ▸ | CA12 | O43570 | 7/20 | 0.62 |
| ▸ | CA9 | Q16790 | 7/20 | 0.62 |
| ▸ | CA1 | P00915 | 4/20 | 0.62 |
| ▸ | LMNA | P02545 | 2/20 | 0.62 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.62 |
| ▸ | CA4 | P22748 | 1/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.56 |
| ▸ | GAA | P10253 | 6/20 | 0.56 |
| ▸ | HPGD | P15428 | 6/20 | 0.56 |
| ▸ | GLA | P06280 | 5/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.56 |
| ▸ | RAB9A | P51151 | 5/20 | 0.56 |
| ▸ | NPC1 | O15118 | 4/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | PKM | P14618 | 2/20 | 0.56 |
| ▸ | CASP1 | P29466 | 2/20 | 0.55 |
| ▸ | CASP7 | P55210 | 2/20 | 0.55 |
| ▸ | MAOB | P27338 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL10134019 | 0.88 | ALDH1A1 (0.62) | ALDH1A1CA12CA9CA1LMNA | |
| SCHEMBL29738214 | 0.88 | ALDH1A1 (0.62) | ALDH1A1CA12CA9CA1LMNA | |
| SCHEMBL3361958 | 0.82 | ALDH1A1 (0.68) | ALDH1A1CA12CA9CA1LMNA | |
| SCHEMBL16266302 | 0.81 | ALDH1A1 (0.66) | ALDH1A1CA12CA9CA1LMNA | |
| SCHEMBL16316724 | 0.81 | ALDH1A1 (0.66) | ALDH1A1CA12CA9CA1LMNA | |
| Hydrochloric Acid SCHEMBL25373064 | 0.79 | ALDH1A1 (0.64) | ALDH1A1CA12CA9CA1LMNA | |
| SCHEMBL20870224 | 0.79 | ALDH1A1 (0.64) | ALDH1A1CA12CA9CA1LMNA | |
| SCHEMBL15607719 | 0.79 | CA12 (0.76) | ALDH1A1CA12CA9CA1LMNA | |
| SCHEMBL29176757 | 0.79 | ALDH1A1 (0.59) | ALDH1A1CA12CA9CA1LMNA | |
| SCHEMBL1034943 | 0.78 | CA12 (0.72) | ALDH1A1CA12CA9CA1LMNA |
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-2017106312-A1 | METHODS OF MODULATING LEVELS OF IL-6 AND PD-L1 | DREXEL UNIVERSITY (US) | 2017-06-22 | — | — | WO | disclosed |