Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | PARP1 | P09874 | 1/20 | 0.46 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | KCNK3 | O14649 | 3/20 | 0.44 |
| ▸ | KCNK9 | Q9NPC2 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2234385 | 1.00 | SMN1; SMN2 (0.49) | SMN1; SMN2HDAC8HDAC6PARP1GPR52 | |
| SCHEMBL933234 | 0.85 | GPR52 (0.47) | SMN1; SMN2HDAC8HDAC6PARP1GPR52 | |
| SCHEMBL933233 | 0.85 | GPR52 (0.47) | SMN1; SMN2HDAC8HDAC6PARP1GPR52 | |
| SCHEMBL15563146 | 0.83 | PARP1 (0.52) | SMN1; SMN2HDAC8HDAC6PARP1GPR52 | |
| SCHEMBL15563147 | 0.83 | PARP1 (0.52) | SMN1; SMN2HDAC8HDAC6PARP1GPR52 | |
| SCHEMBL3310563 | 0.83 | NFE2L2 (0.53) | SMN1; SMN2MAPTALDH1A1POLBMEN1 | |
| SCHEMBL2232374 | 0.83 | NFE2L2 (0.53) | SMN1; SMN2MAPTALDH1A1POLBMEN1 | |
| SCHEMBL2232370 | 0.83 | NFE2L2 (0.53) | SMN1; SMN2MAPTALDH1A1POLBMEN1 | |
| SCHEMBL2232262 | 0.83 | MAOB (0.57) | SMN1; SMN2PARP1GPR52MAPTALDH1A1 | |
| SCHEMBL2232266 | 0.83 | MAOB (0.57) | SMN1; SMN2PARP1GPR52MAPTALDH1A1 |
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-2011092505-A1 | S100 PROTEIN BINDING INTERACTION INHIBITORS | CANCER RESEARCH TECHNOLOGY LIMITED (GB) | 2011-08-04 | — | — | WO | disclosed |