Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.62 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.62 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.62 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.62 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.62 |
| ▸ | TNKS | O95271 | 1/20 | 0.62 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.62 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.62 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.62 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.62 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.62 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.62 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.62 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.62 |
| ▸ | TP53 | P04637 | 1/20 | 0.61 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.61 |
| ▸ | CDK9 | P50750 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL8195098 | 1.00 | HDAC1 (0.62) | HDAC1HDAC8HDAC6HCAR2HDAC3 | |
| SCHEMBL11996395 | 0.87 | SMN1; SMN2 (0.68) | TP53EPHX1TSHREPHX2CDK9 | |
| SCHEMBL11996396 | 0.87 | SMN1; SMN2 (0.68) | TP53EPHX1TSHREPHX2CDK9 | |
| SCHEMBL292963 | 0.85 | HCAR2 (0.67) | HDAC1HDAC8HDAC6HCAR2HDAC3 | |
| SCHEMBL292964 | 0.85 | HCAR2 (0.67) | HDAC1HDAC8HDAC6HCAR2HDAC3 | |
| SCHEMBL7747810 | 0.85 | RAB9A (0.64) | SMN1; SMN2KMT2AMEN1CASP3SENP7 | |
| SCHEMBL7747808 | 0.85 | RAB9A (0.64) | SMN1; SMN2KMT2AMEN1CASP3SENP7 | |
| SCHEMBL19501838 | 0.84 | MMP1 (0.86) | SMN1; SMN2MMP1MMP2MMP9MAOA | |
| SCHEMBL7746675 | 0.84 | ALDH1A1 (0.53) | HDAC1HDAC8HDAC6HCAR2HDAC3 | |
| SCHEMBL7746671 | 0.84 | ALDH1A1 (0.53) | HDAC1HDAC8HDAC6HCAR2HDAC3 |
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 |
|---|---|---|---|---|---|---|---|
| US-6117881-A | POTENT AND SELECTIVE INHIBITORS OF CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE SPECIFIC PHOSPHODIESTERASE | ICOS CORPORATION (US) | 2000-09-12 | — | — | US | disclosed |