Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.49 |
| ▸ | CA9 | Q16790 | 2/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | CA4 | P22748 | 1/20 | 0.49 |
| ▸ | CA6 | P23280 | 1/20 | 0.49 |
| ▸ | CA5A | P35218 | 1/20 | 0.49 |
| ▸ | CA7 | P43166 | 1/20 | 0.49 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.49 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL11685718 | 0.87 | MAPT (0.46) | CA12CA9CA1CA2ALDH1A1 | |
| SCHEMBL11657083 | 0.83 | ALDH1A1 (0.47) | CA12CA9CA1CA2CA4 | |
| Methane SCHEMBL11681369 | 0.82 | ALDH1A1 (0.46) | CA12CA9CA1CA2CA4 | |
| SCHEMBL879153 | 0.79 | CA1 (0.68) | CA12CA9CA1CA2CA4 | |
| SCHEMBL31208448 | 0.79 | CA1 (0.68) | CA12CA9CA1CA2CA4 | |
| SCHEMBL11039125 | 0.78 | CA12 (0.61) | CA12CA9CA1CA2CA4 | |
| SCHEMBL11686057 | 0.77 | PGR (0.51) | ALDH1A1CYP3A4NPC1RAB9APGR | |
| SCHEMBL13577030 | 0.77 | PGR (0.52) | CA12CA9CA1CA2CA4 | |
| SCHEMBL13577038 | 0.74 | FFAR1 (0.50) | ALDH1A1MAPTMCOLN3HPGDRECQL | |
| SCHEMBL13577029 | 0.74 | MAPT (0.44) | ALDH1A1MAPTMCOLN3NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-4055557-A | MONOAZO DYES | BAYER AKTIENGESELLSCHAFT (DT) | 1977-10-25 | — | — | US | disclosed |