Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 12/20 | 0.42 |
| ▸ | CA12 | O43570 | 5/20 | 0.42 |
| ▸ | CA1 | P00915 | 5/20 | 0.42 |
| ▸ | CA9 | Q16790 | 5/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | MMP14 | P50281 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 4/20 | 0.41 |
| ▸ | CA6 | P23280 | 4/20 | 0.41 |
| ▸ | CA5A | P35218 | 4/20 | 0.41 |
| ▸ | CA7 | P43166 | 4/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.41 |
| ▸ | CA5B | Q9Y2D0 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5675225 | 0.86 | CA2 (0.59) | HSD17B10ALDH1A1CA2CA12CA1 | |
| SCHEMBL5674072 | 0.84 | CA2 (0.59) | HSD17B10ALDH1A1CA2CA12CA1 | |
| SCHEMBL9335209 | 0.83 | HSD17B10 (0.49) | HSD17B10ALDH1A1CA2CA12CA1 | |
| SCHEMBL11222680 | 0.80 | GAA (0.52) | HSD17B10ALDH1A1CA2CA12CA1 | |
| SCHEMBL9360020 | 0.80 | SERPINE1 (0.46) | HSD17B10ALDH1A1CA2CA12CA1 | |
| SCHEMBL6029167 | 0.79 | HSD17B10 (0.45) | HSD17B10ALDH1A1CA2CA12CA1 | |
| SCHEMBL10411983 | 0.79 | HSD17B10 (0.41) | HSD17B10ALDH1A1CA2CA12CA1 | |
| SCHEMBL8951864 | 0.77 | MAPT (0.45) | ALDH1A1CA2CA12CA1CA9 | |
| SCHEMBL11042235 | 0.76 | HSD17B10 (0.44) | HSD17B10ALDH1A1CA2CA12CA1 | |
| Ethylenediamine SCHEMBL11368890 | 0.76 | GAA (0.47) | HSD17B10ALDH1A1CA2CA12CA1 |
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-4939243-A | Water-soluble copper complex disazo compounds containg a chloro triazinylamino group and a group of the vinylsulfone series as fiber-reactive groups and their dyestuffs | HOECHST AKTIENGESELLSCHAFT (DE) | 1990-07-03 | — | — | US | disclosed |