Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.40 |
| ▸ | MMP8 | P22894 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KCNN4 | O15554 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21677219 | 1.00 | HDAC3 (0.41) | HDAC3HDAC4HDAC1HDAC6TAAR1 | |
| SCHEMBL16214774 | 0.81 | KCNN4 (0.40) | HDAC3HDAC4HDAC1HDAC6LMNA | |
| SCHEMBL1477878 | 0.80 | POLB (0.46) | HDAC3HDAC4HDAC1HDAC6TAAR1 | |
| SCHEMBL30603802 | 0.80 | PIN1 (0.45) | TAAR1LMNANPSR1POLBL3MBTL1 | |
| SCHEMBL18113457 | 0.80 | PIN1 (0.45) | TAAR1LMNANPSR1POLBL3MBTL1 | |
| SCHEMBL31355016 | 0.79 | PIN1 (0.47) | TAAR1LMNANPSR1POLBL3MBTL1 | |
| SCHEMBL8871352 | 0.78 | POLB (0.42) | HDAC3HDAC4HDAC1HDAC6TAAR1 | |
| SCHEMBL15948290 | 0.77 | POLB (0.48) | HDAC3HDAC4HDAC1HDAC6TAAR1 | |
| SCHEMBL6904757 | 0.76 | POLB (0.44) | TAAR1LMNANPSR1POLBL3MBTL1 | |
| SCHEMBL18682960 | 0.76 | TAAR1 (0.41) | TAAR1LMNAPOLBL3MBTL1MMP8 |
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-2017050978-A1 | 2,3,4,5-TETRAHYDROPYRIDIN-6-AMINE DERIVATIVES | JANSSEN PHARMACEUTICA NV (BE) | 2017-03-30 | — | — | WO | disclosed |