Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CLK1 | P49759 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL25318355 | 0.82 | HDAC1 (0.36) | HDAC1HDAC8HDAC6ALDH1A1ALOX12 | |
| SCHEMBL30507436 | 0.82 | HDAC1 (0.36) | HDAC1HDAC8HDAC6ALDH1A1ALOX12 | |
| SCHEMBL3245592 | 0.81 | ALDH1A1 (0.37) | HDAC1HDAC8HDAC6ALDH1A1GAA | |
| SCHEMBL30506707 | 0.78 | HDAC1 (0.34) | HDAC1HDAC8HDAC6ALDH1A1ALOX12 | |
| SCHEMBL25316939 | 0.78 | HDAC1 (0.34) | HDAC1HDAC8HDAC6ALDH1A1ALOX12 | |
| SCHEMBL3241068 | 0.78 | CYP11B2 (0.41) | — | |
| SCHEMBL3123128 | 0.77 | HTT (0.49) | ALDH1A1GAAAKR1B1TSHRMEN1 | |
| SCHEMBL26040102 | 0.76 | BACE1 (0.35) | HDAC1HDAC8HDAC6ALDH1A1MAPT | |
| SCHEMBL4113410 | 0.74 | HSD17B10 (0.38) | — | |
| SCHEMBL3244879 | 0.74 | LMNA (0.38) | ALDH1A1GAAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010008777-A2 | FUSED AZABICYCLIC PYRIDINES | LIGAND PHARMACEUTICALS INC. (US) | 2010-01-21 | — | — | WO | disclosed |
| WO-2010008777-A2 | FUSED AZABICYCLIC PYRIDINES | LIGAND PHARMACEUTICALS INC. (US) | 2010-01-21 | — | — | WO | disclosed |