Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 2/20 | 0.37 |
| ▸ | MMP9 | P14780 | 2/20 | 0.37 |
| ▸ | FBP1 | P09467 | 2/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 7/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 7/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 7/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 7/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 7/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 7/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 7/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 7/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 7/20 | 0.36 |
| ▸ | HDAC9 | Q9UKV0 | 7/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 7/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 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 | |
|---|---|---|---|---|
| SCHEMBL1710540 | 1.00 | CA1 (0.38) | CA1CA2SMN1; SMN2MMP2MMP9 | |
| SCHEMBL3385274 | 0.84 | SMN1; SMN2 (0.42) | CA1CA2SMN1; SMN2FBP1HDAC3 | |
| SCHEMBL3385268 | 0.84 | SMN1; SMN2 (0.42) | CA1CA2SMN1; SMN2FBP1HDAC3 | |
| SCHEMBL1710542 | 0.81 | SMN1; SMN2 (0.38) | CA1CA2SMN1; SMN2MMP2MMP9 | |
| SCHEMBL3388394 | 0.78 | CTSL (0.38) | CA1CA2SMN1; SMN2FBP1HDAC3 | |
| SCHEMBL3388391 | 0.78 | CTSL (0.38) | CA1CA2SMN1; SMN2FBP1HDAC3 | |
| SCHEMBL1710642 | 0.69 | SMN1; SMN2 (0.49) | CA2SMN1; SMN2BRD4 | |
| SCHEMBL27821808 | 0.68 | SMN1; SMN2 (0.72) | CA1CA2SMN1; SMN2MMP2MMP9 | |
| SCHEMBL2541681 | 0.67 | PAM (0.55) | SMN1; SMN2HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL1710532 | 0.66 | HTR6 (0.51) | CA1CA2SMN1; SMN2HTR6F2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2344451-A2 | SULFUR-LINKED COMPOUNDS FOR TREATING OPTHALMIC DISEASES AND DISORDERS | Acucela, Inc. (US) | 2011-07-20 | — | — | EP | disclosed |