Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.47 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | PDE4A | P27815 | 1/20 | 0.37 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.37 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.37 |
| ▸ | HTR3E | A5X5Y0 | 3/20 | 0.36 |
| ▸ | HTR3B | O95264 | 3/20 | 0.36 |
| ▸ | HTR3A | P46098 | 3/20 | 0.36 |
| ▸ | HTR3D | Q70Z44 | 3/20 | 0.36 |
| ▸ | HTR3C | Q8WXA8 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7679009 | 0.98 | CYP1A2 (0.44) | CYP1A2CHRM3PDE4APDE4BPDE4C | |
| SCHEMBL7676555 | 0.81 | CYP1A2 (0.50) | CYP1A2KMT2AMEN1SMN1; SMN2CRHBP | |
| SCHEMBL16333725 | 0.71 | HTR3E (0.68) | CYP1A2HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL19673985 | 0.71 | CYP1A2 (0.68) | CYP1A2CHRM3PDE4APDE4BPDE4C | |
| SCHEMBL31558499 | 0.71 | CYP1A2 (0.68) | CYP1A2CHRM3PDE4APDE4BPDE4C | |
| SCHEMBL939716 | 0.68 | ALDH1A1 (0.70) | CYP1A2HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL16334097 | 0.68 | HTR3E (0.70) | CYP1A2HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL6402539 | 0.68 | SMN1; SMN2 (0.50) | CYP1A2CHRM3PDE4APDE4BPDE4C | |
| SCHEMBL6017340 | 0.68 | CHRM3 (0.47) | CYP1A2CHRM3PDE4APDE4BPDE4C | |
| SCHEMBL1042655 | 0.68 | CYP1A2 (0.46) | CYP1A2CHRM3PDE4APDE4BPDE4C |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1146542-C | Benzamide derivatives and their use as cytokine inhibitors | — | 2004-04-21 | — | — | CN | disclosed |
| US-6455520-B1 | TUMOR NECROSIS FACTOR AND INTERLEUKIN INHIBITORS; ANTIINFLAMMATORY AGENTS, ANTIALLERGENS; BONE DISORDERS | ASTRA ZENECA AB (SE) | 2002-09-24 | — | — | US | disclosed |
| CN-1319092-A | Benzamide derivatives and their use as cytokine inhibitors | ASTRAZENECA AB (SE) | 2001-10-24 | — | — | CN | disclosed |