Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | PTGER4 | P35408 | 3/20 | 0.41 |
| ▸ | PTGER3 | P43115 | 3/20 | 0.41 |
| ▸ | PTGER2 | P43116 | 3/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.41 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.41 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.40 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.39 |
| ▸ | IP6K3 | Q96PC2 | 1/20 | 0.39 |
| ▸ | IP6K2 | Q9UHH9 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| SCHEMBL38659157 | 0.93 | HDAC8 (0.44) | HDAC8HDAC3HDAC1NCOR2MAOB | |
| SCHEMBL19257274 | 0.93 | HDAC8 (0.44) | HDAC8HDAC3HDAC1NCOR2MAOB | |
| SCHEMBL19257536 | 0.90 | HSD17B1 (0.47) | HDAC8HDAC3HDAC1NCOR2MAOB | |
| SCHEMBL19257268 | 0.88 | HDAC8 (0.45) | HDAC8HDAC3HDAC1NCOR2MAOB | |
| SCHEMBL19257277 | 0.88 | AKR1C3 (0.44) | HDAC8HDAC3HDAC1NCOR2PTGER4 | |
| SCHEMBL19257224 | 0.87 | HDAC8 (0.44) | HDAC8HDAC3HDAC1NCOR2MAOB | |
| SCHEMBL19257225 | 0.86 | HDAC8 (0.43) | HDAC8HDAC3HDAC1NCOR2MAOB | |
| SCHEMBL19257276 | 0.86 | P4HB (0.43) | HDAC8HDAC3HDAC1NCOR2PTGER4 | |
| SCHEMBL19257715 | 0.86 | PLAU (0.45) | HDAC8HDAC3HDAC1NCOR2MAOB | |
| SCHEMBL19257541 | 0.86 | JUN (0.52) | GAARELAATMJUNNFKB1 |
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 |