Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.32 |
| ▸ | KDM4A | O75164 | 1/20 | 0.32 |
| ▸ | PHF8 | Q9UPP1 | 1/20 | 0.32 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.31 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.31 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1709947 | 1.00 | CA1 (0.35) | CA1KDM4CKDM4APHF8KDM2A | |
| SCHEMBL9915023 | 1.00 | CA1 (0.35) | CA1KDM4CKDM4APHF8KDM2A | |
| SCHEMBL19955121 | 0.90 | KDM4C (0.40) | KDM4CKDM4APHF8KDM2ACHRNB2 | |
| SCHEMBL15187247 | 0.85 | MMP9 (0.32) | — | |
| SCHEMBL17920012 | 0.85 | MMP9 (0.32) | — | |
| SCHEMBL17920016 | 0.85 | MMP9 (0.32) | — | |
| SCHEMBL25919388 | 0.84 | GAA (0.31) | — | |
| SCHEMBL16022889 | 0.81 | ALDH1A1 (0.46) | KDM4CKDM4APHF8CHRNB2CHRNA4 | |
| SCHEMBL20880284 | 0.81 | CA1 (0.32) | CA1 | |
| SCHEMBL16360268 | 0.79 | CA1 (0.38) | CA1KDM4CKDM4APHF8KDM2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016112321-A1 | CYCLOSPORIN DERIVATIVES WHEREIN THE MEBMT SIDECHAIN HAS BEEN CYCLIZED | ALLERGAN, INC. (US) | 2016-07-14 | — | — | WO | disclosed |