Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS2R38 | P59533 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | MGLL | Q99685 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL48252 | 0.96 | TAS2R38 (0.44) | TAS2R38CA12CA1CA2CA9 | |
| SCHEMBL78579 | 0.93 | TAS2R38 (0.41) | TAS2R38CA12CA1CA2CA9 | |
| Water SCHEMBL22229904 | 0.93 | TAS2R38 (0.41) | TAS2R38CA12CA1CA2CA9 | |
| SCHEMBL409999 | 0.93 | TAS2R38 (0.41) | TAS2R38CA12CA1CA2CA9 | |
| Water SCHEMBL16026411 | 0.93 | TAS2R38 (0.41) | TAS2R38CA12CA1CA2CA9 | |
| Ammonia Solution, Strong SCHEMBL1617520 | 0.93 | TAS2R38 (0.41) | TAS2R38CA12CA1CA2CA9 | |
| SCHEMBL9356019 | 0.93 | TAS2R38 (0.41) | TAS2R38CA12CA1CA2CA9 | |
| SCHEMBL3838623 | 0.93 | TAS2R38 (0.41) | TAS2R38CA12CA1CA2CA9 | |
| SCHEMBL1477499 | 0.93 | TAS2R38 (0.41) | TAS2R38CA12CA1CA2CA9 | |
| SCHEMBL23193 | 0.93 | TAS2R38 (0.41) | TAS2R38CA12CA1CA2CA9 |
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-4018611-A | Non-yellowing antimicrobial compositions comprising diiodomethyl sulfones | METALORGANA ETABLISSEMENT (FL) | 1977-04-19 | — | — | US | disclosed |