Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 1/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | VCP | P55072 | 1/20 | 0.32 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 4/20 | 0.31 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.31 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.30 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6848088 | 0.86 | ADRB2 (0.44) | ADRB2CLK4AOC3CYP2A6VCP | |
| SCHEMBL6876158 | 0.83 | ASIC3 (0.46) | ADRB2CLK4AOC3VCPASIC3 | |
| SCHEMBL6875742 | 0.80 | GABRP (0.41) | ADRB2CLK4AOC3ASIC3CHRNB2 | |
| SCHEMBL6227667 | 0.79 | ALDH1A1 (0.46) | ADRB2CLK4AOC3CYP2A6VCP | |
| SCHEMBL6854012 | 0.76 | CLK4 (0.44) | ADRB2CLK4AOC3CYP2A6VCP | |
| SCHEMBL6881941 | 0.75 | ADRB2 (0.44) | ADRB2CLK4AOC3CYP2A6VCP | |
| SCHEMBL5541163 | 0.73 | CYP1A2 (0.54) | FFAR1FFAR4 | |
| SCHEMBL6685962 | 0.69 | CLK4 (0.64) | ADRB2CLK4AOC3CYP2A6 | |
| SCHEMBL20985726 | 0.69 | CLK4 (0.46) | ADRB2CLK4AOC3CYP2A6VCP | |
| SCHEMBL6275261 | 0.68 | ADRB2 (0.59) | ADRB2CLK4AOC3CYP2A6 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1585775-A | 6-O-acyl ketolide derivatives of erythromycine useful as antibacterials | ORTHO MCNEIL PHARM INC (US) | 2005-02-23 | — | — | CN | disclosed |
| US-6825170-B2 | ERYTHROMYCIN TYPE MACROLIDE WITH A FUSED OXAZOLONE RING | ORTHO-MCNEIL PHARMACEUTICAL, INC. | 2004-11-30 | — | — | US | disclosed |
| EP-1453847-A1 | 6-O-ACYL KETOLIDE DERIVATIVES OF ERYTHROMYCINE USEFUL AS ANTIBACTERIALS | Ortho-Mcneil Pharmaceutical, Inc. (US) | 2004-09-08 | — | — | EP | disclosed |
| WO-2003050132-A1 | 6-O-ACYL KETOLIDE DERIVATIVES OF ERYTHROMYCINE USEFUL AS ANTIBACTERIALS | ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) | 2003-06-19 | — | — | WO | disclosed |