Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 14/20 | 0.54 |
| ▸ | CCR2 | P41597 | 14/20 | 0.54 |
| ▸ | CCR4 | P51679 | 11/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.47 |
| ▸ | F2 | P00734 | 1/20 | 0.43 |
| ▸ | F10 | P00742 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL14610530 | 0.81 | CCR1 (0.49) | CCR1CCR2CCR4CYP3A4CYP2C9 | |
| SCHEMBL14610740 | 0.78 | GAA (0.44) | CYP3A4CYP2C9F2F10 | |
| SCHEMBL8801557 | 0.77 | CYP19A1 (0.58) | CCR1CCR2CCR4CYP19A1 | |
| SCHEMBL29820095 | 0.74 | CYP19A1 (0.69) | CCR1CCR2CCR4CYP3A4CYP2C9 | |
| SCHEMBL5468353 | 0.74 | DPP4 (0.50) | CCR1CCR2CCR4CYP3A4CYP2C9 | |
| SCHEMBL14610401 | 0.73 | CCR1 (0.46) | CCR1CCR2CCR4CYP3A4CYP19A1 | |
| SCHEMBL5306950 | 0.72 | CYP11B1 (0.58) | CYP3A4CYP19A1 | |
| SCHEMBL21784837 | 0.72 | KMT2A (0.46) | CCR1CCR2CCR4CYP3A4CYP2C9 | |
| SCHEMBL7445529 | 0.72 | CCR1 (0.50) | CCR1CCR2CCR4CYP19A1F2 | |
| SCHEMBL29820100 | 0.71 | CYP19A1 (0.69) | CCR1CCR2CCR4CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007014054-A2 | BENZENESULFONAMIDE INHIBITOR OF CCR2 CHEMOKINE RECEPTOR | GLAXO GROUP LIMTED (GB) | 2007-02-01 | — | — | WO | disclosed |
| WO-2007014054-A2 | BENZENESULFONAMIDE INHIBITOR OF CCR2 CHEMOKINE RECEPTOR | GLAXO GROUP LIMTED (GB) | 2007-02-01 | — | — | WO | disclosed |