Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 18/20 | 0.54 |
| ▸ | CA1 | P00915 | 12/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | CA12 | O43570 | 8/20 | 0.53 |
| ▸ | CA9 | Q16790 | 7/20 | 0.53 |
| ▸ | CA4 | P22748 | 5/20 | 0.53 |
| ▸ | CA6 | P23280 | 5/20 | 0.53 |
| ▸ | CA5A | P35218 | 5/20 | 0.53 |
| ▸ | CA7 | P43166 | 5/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 5/20 | 0.53 |
| ▸ | CA5B | Q9Y2D0 | 5/20 | 0.53 |
| ▸ | CA3 | P07451 | 1/20 | 0.51 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL19941420 | 1.00 | CA2 (0.54) | CA2CA1KDM4ESMN1; SMN2CA12 | |
| SCHEMBL30998999 | 0.86 | SLC7A5 (0.62) | CA2CA1KDM4ESMN1; SMN2CA12 | |
| SCHEMBL18926112 | 0.84 | EPHX1 (0.51) | KDM4ESMN1; SMN2 | |
| SCHEMBL10251218 | 0.84 | EPHX1 (0.51) | KDM4ESMN1; SMN2 | |
| SCHEMBL2072326 | 0.83 | SLC7A5 (0.53) | CA2CA1CA12 | |
| SCHEMBL2072328 | 0.83 | SLC7A5 (0.53) | CA2CA1CA12 | |
| SCHEMBL27734534 | 0.81 | SLC7A5 (0.57) | CA2CA1KDM4ESMN1; SMN2CA12 | |
| SCHEMBL19938091 | 0.81 | CA2 (0.53) | CA2CA1KDM4ESMN1; SMN2CA12 | |
| SCHEMBL15881217 | 0.81 | CA2 (0.53) | CA2CA1KDM4ESMN1; SMN2CA12 | |
| SCHEMBL6951101 | 0.78 | CA2 (0.62) | CA2CA1KDM4ESMN1; SMN2CA12 |
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-8841263-B2 | Macrocyclic compounds and methods of making and using the same | MELINTA THERAPEUTICS, INC. (US) | 2014-09-23 | — | — | US | disclosed |