Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 2/20 | 0.38 |
| ▸ | CNR2 | P34972 | 2/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.38 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | DDX3X | O00571 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13564959 | 0.85 | CNR1 (0.42) | HTR6CNR2ALDH1A1EPHX1MAPT | |
| SCHEMBL11935546 | 0.85 | SMN1; SMN2 (0.40) | CNR2ALDH1A1EPHX1POLBMAPT | |
| SCHEMBL13565777 | 0.84 | UQCRB (0.42) | CNR2ALDH1A1CA12CA1CA2 | |
| SCHEMBL13105242 | 0.84 | CNR2 (0.36) | CNR2HDAC6ALDH1A1CA12CA1 | |
| SCHEMBL13565411 | 0.83 | CA1 (0.41) | CNR2ALDH1A1CA12CA1CA2 | |
| SCHEMBL13565885 | 0.83 | ALDH1A1 (0.50) | HDAC6HDAC3HDAC1HDAC2ALDH1A1 | |
| SCHEMBL11935642 | 0.83 | CDK1 (0.44) | HDAC6HDAC3HDAC1HDAC2HDAC10 | |
| SCHEMBL13564900 | 0.83 | PTGS1 (0.41) | CNR2HDAC6HDAC3HDAC4HDAC1 | |
| SCHEMBL11935609 | 0.82 | HTR7 (0.47) | HDAC6HDAC1HDAC8CA12CA1 | |
| SCHEMBL11934928 | 0.82 | ALDH1A1 (0.38) | CNR2HDAC6HDAC4HDAC10HDAC5 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9139518-B2 | Amine derivative having NPY Y5 receptor antagonistic activity | SHIONOGI & CO., LTD. (JP) | 2015-09-22 | — | — | US | disclosed |
| US-8299265-B2 | Amine derivatives having NPY Y5 receptor antagonistic activity and the uses thereof | SHIONOGI & CO., LTD. (JP) | 2012-10-30 | — | — | US | disclosed |