Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 8/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 7/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.44 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.40 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.40 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.40 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.40 |
| ▸ | PIK3C3 | Q8NEB9 | 2/20 | 0.39 |
| ▸ | CNR2 | P34972 | 2/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.38 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL21732287 | 0.79 | HDAC6 (0.51) | HDAC6HDAC8HDAC1HDAC5NUDT1 | |
| SCHEMBL21732189 | 0.73 | RORC (0.48) | — | |
| SCHEMBL21732190 | 0.72 | RORC (0.35) | HDAC6HDAC8HDAC1DGAT1 | |
| SCHEMBL21732073 | 0.72 | MEN1 (0.42) | NTRK1PIK3C3SMN1; SMN2MAOAMAOB | |
| SCHEMBL21732282 | 0.69 | NTRK1 (0.40) | HDAC6HDAC8HDAC1NTRK1NTRK3 | |
| SCHEMBL4582373 | 0.67 | CDK2 (0.52) | NTRK2NUDT1 | |
| SCHEMBL4582377 | 0.67 | CDK2 (0.52) | NTRK2NUDT1 | |
| SCHEMBL21732260 | 0.66 | HDAC6 (0.41) | HDAC6HDAC8HDAC1NUDT1MAPT | |
| SCHEMBL20319863 | 0.65 | HDAC6 (0.45) | HDAC6HDAC8HDAC1CNR2HDAC5 | |
| SCHEMBL21732286 | 0.65 | HDAC6 (0.44) | HDAC6HDAC8HDAC1HDAC5NUDT1 |
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-2020035557-A1 | NOVEL HETEROAROMATIC MODULATORS OF THE RETINOID-RELATED ORPHAN RECEPTOR GAMMA | LEO PHARMA A/S (DK) | 2020-02-20 | — | — | WO | disclosed |