Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | ERN1 | O75460 | 3/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.40 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.40 |
| ▸ | IP6K3 | Q96PC2 | 1/20 | 0.40 |
| ▸ | IP6K2 | Q9UHH9 | 1/20 | 0.40 |
| ▸ | JUN | P05412 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.39 |
| ▸ | PTGER3 | P43115 | 2/20 | 0.39 |
| ▸ | PTGER2 | P43116 | 2/20 | 0.39 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL19257225 | 0.90 | HDAC8 (0.43) | HDAC8HDAC3HDAC1NCOR2MAOB | |
| SCHEMBL19257268 | 0.90 | HDAC8 (0.45) | HDAC8HDAC3HDAC1NCOR2MAOB | |
| SCHEMBL19257279 | 0.87 | HSD17B1 (0.47) | HDAC8HDAC3HDAC1NCOR2MAOB | |
| SCHEMBL19257540 | 0.87 | HDAC8 (0.43) | HDAC8HDAC3HDAC1NCOR2MAOB | |
| SCHEMBL19257274 | 0.86 | HDAC8 (0.44) | HDAC8HDAC3HDAC1NCOR2MAOB | |
| SCHEMBL38659157 | 0.86 | HDAC8 (0.44) | HDAC8HDAC3HDAC1NCOR2MAOB | |
| SCHEMBL19257269 | 0.86 | PTGER4 (0.43) | HDAC8HDAC3HDAC1NCOR2GAA | |
| SCHEMBL15959114 | 0.86 | MAOB (0.51) | MAOBGAAERN1 | |
| SCHEMBL15385198 | 0.86 | BACE1 (0.54) | MAOBERN1PTGER1PTGER3PTGER2 | |
| SCHEMBL19257202 | 0.85 | XDH (0.50) | HDAC8HDAC3HDAC1NCOR2MAOB |
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-2017134146-A1 | GPBP INHIBITORS AND USES AND SCALEABLE SYNTHESIS THEREOF | FIBROSTATIN, S.L. (ES) | 2017-08-10 | — | — | WO | disclosed |