Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.45 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.44 |
| ▸ | HTR3B | O95264 | 1/20 | 0.44 |
| ▸ | HTR3A | P46098 | 1/20 | 0.44 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.44 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.43 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | DRD1 | P21728 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL27470535 | 0.89 | HDAC6 (0.44) | HDAC1HDAC6HTR3EHTR3BHTR3A | |
| SCHEMBL9056969 | 0.82 | CA1 (0.48) | HDAC1HDAC6HTR3EHTR3BHTR3A | |
| SCHEMBL9055755 | 0.80 | CHRM2 (0.50) | HDAC1HDAC6CHRM2HTR1AADRA2A | |
| SCHEMBL27470534 | 0.78 | HDAC6 (0.46) | HDAC1HDAC6HTR3EHTR3BHTR3A | |
| SCHEMBL8387262 | 0.78 | HDAC1 (0.47) | HDAC1HDAC6P2RX4CHRM2HTR1A | |
| SCHEMBL27470537 | 0.77 | P2RX4 (0.50) | HDAC1HDAC6P2RX4CHRM2HTR1A | |
| SCHEMBL9056678 | 0.77 | HDAC1 (0.49) | HDAC1HDAC6HTR3EHTR3BHTR3A | |
| SCHEMBL27489205 | 0.72 | CA1 (0.46) | HDAC1HDAC6HTR3EHTR3BHTR3A | |
| SCHEMBL9057318 | 0.71 | HDAC6 (0.48) | HDAC1HDAC6CHRM2HTR1AADRA2A | |
| SCHEMBL30480036 | 0.71 | HDAC1 (0.70) | HDAC1HDAC6P2RX4CHRM2HTR1A |
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 |
|---|---|---|---|---|---|---|---|
| CN-1166169-A | Heterocyclic compounds, useful as allosteric effectors at muscarinic receptors | SANKYO CO (JP) | 1997-11-26 | — | — | CN | disclosed |
| WO-1996003377-A1 | HETEROCYCLIC COMPOUNDS, USEFUL AS ALLOSTERIC EFFECTORS AT MUSCARINIC RECEPTORS | SANKYO COMPANY, LIMITED (JP) | 1996-02-08 | — | — | WO | disclosed |