Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.46 |
| ▸ | NOS1 | P29475 | 1/20 | 0.46 |
| ▸ | NOS2 | P35228 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | PKM | P14618 | 5/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | GLA | P06280 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 3/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | NAMPT | P43490 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 2/20 | 0.39 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.39 |
| ▸ | CCR3 | P51677 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6779087 | 0.94 | NOS3 (0.48) | NOS3NOS1NOS2ALDH1A1PKM | |
| SCHEMBL6773077 | 0.89 | MCHR1 (0.49) | GAAHDAC3NAMPT | |
| SCHEMBL6774104 | 0.87 | POLB (0.44) | GAAPOLBHDAC3HDAC1TLR7 | |
| SCHEMBL6775222 | 0.87 | TLR7 (0.46) | NOS3NOS1NOS2ALDH1A1PKM | |
| SCHEMBL6772992 | 0.85 | HDAC3 (0.40) | ALDH1A1GAAHDAC3HDAC1SIGMAR1 | |
| SCHEMBL6768544 | 0.85 | NPC1 (0.49) | ALDH1A1HPGDPOLBHDAC3HDAC1 | |
| SCHEMBL6773218 | 0.83 | MCHR1 (0.47) | NOS3NOS1NOS2ALDH1A1PKM | |
| SCHEMBL6779944 | 0.83 | HDAC3 (0.48) | HDAC3HDAC1SIGMAR1DRD3TMEM97 | |
| SCHEMBL6773965 | 0.83 | BRD4 (0.44) | ALDH1A1KDM4EDRD3TLR7 | |
| SCHEMBL6773275 | 0.82 | TRPV1 (0.43) | HDAC3HDAC1TLR7 |
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-6720333-B2 | IMMUNE RESPONSE MODIFIERS; CYTOKINE BIOSYNTHESIS; VIRAL AND NEOPLASTIC DISEASES; N-(4-(4-AMINO-6,7-DIMETHYL-1H-IMIDAZO (4,5-C)PYRIDIN-1-YL)BUTYL)BENZAMIDE | 3M INNOVATIVE PROPERTIES COMPANY | 2004-04-13 | — | — | US | claimed |