Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB11 | O95342 | 2/20 | 0.73 |
| ▸ | CCR1 | P32246 | 1/20 | 0.70 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.42 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.41 |
| ▸ | CCR5 | P51681 | 4/20 | 0.41 |
| ▸ | CCR2 | P41597 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | SLC6A12 | P48065 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 2/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4666529 | 1.00 | ABCB11 (0.73) | ABCB11CCR1SIGMAR1MCHR1CCR5 | |
| SCHEMBL2061810 | 0.90 | ABCB11 (0.75) | ABCB11CCR1SIGMAR1MCHR1CCR5 | |
| SCHEMBL4998445 | 0.90 | ABCB11 (0.69) | ABCB11CCR1SIGMAR1MCHR1CCR5 | |
| Benzoic Acid SCHEMBL4998239 | 0.89 | ABCB11 (0.72) | ABCB11CCR1SIGMAR1MCHR1CCR5 | |
| SCHEMBL1950538 | 0.87 | CCR1 (0.80) | ABCB11CCR1SIGMAR1MCHR1CCR5 | |
| Azd4818 SCHEMBL2061809 | 0.85 | CCR1 (0.88) | ABCB11CCR1SIGMAR1MCHR1CCR5 | |
| SCHEMBL3807493 | 0.85 | ABCB11 (1.00) | ABCB11CCR1SIGMAR1MCHR1CCR5 | |
| SCHEMBL3814775 | 0.85 | ABCB11 (1.00) | ABCB11CCR1SIGMAR1MCHR1CCR5 | |
| SCHEMBL3810728 | 0.85 | ABCB11 (1.00) | ABCB11CCR1SIGMAR1MCHR1CCR5 | |
| SCHEMBL4666533 | 0.84 | ABCB11 (0.61) | ABCB11CCR1SIGMAR1MCHR1CCR5 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1912942-A1 | NOVEL PIPERIDINE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS USEFUL FOR THE TREATMENT OF RESPIRATORY DISEASES. | AstraZeneca AB (SE) | 2008-04-23 | — | — | EP | disclosed |
| WO-2007015664-A1 | NOVEL PIPERIDINE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS USEFUL FOR THE TREATMENT OF RESPIRATORY DISEASES. | ASTRAZENECA AB (SE) | 2007-02-08 | — | — | WO | disclosed |