Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | CA7 | P43166 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CTSK | P43235 | 9/20 | 0.44 |
| ▸ | CTSS | P25774 | 5/20 | 0.44 |
| ▸ | CTSL | P07711 | 1/20 | 0.41 |
| ▸ | CTSB | P07858 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | PREP | P48147 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL19102018 | 1.00 | CA1 (0.52) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL13508405 | 1.00 | CA1 (0.52) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL15081440 | 1.00 | CA1 (0.52) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL3688851 | 1.00 | CA1 (0.52) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL30660637 | 1.00 | CA1 (0.52) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL23622224 | 1.00 | CA1 (0.52) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL24069882 | 0.89 | CA1 (0.57) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL20725932 | 0.87 | CA1 (0.52) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL7889210 | 0.84 | CA1 (0.58) | CA1CA2CA7CYP2D6CTSK | |
| SCHEMBL10015869 | 0.84 | CA1 (0.58) | CA1CA2CA7CYP2D6CTSK |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022076621-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |
| US-6010733-A | ARTIFICIAL SWEETENER | AJINOMOTO CO., INC. (JP) | 2000-01-04 | — | — | US | disclosed |