Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.41 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.41 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.37 |
| ▸ | CCR2 | P41597 | 2/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | CCR4 | P51679 | 1/20 | 0.36 |
| ▸ | CCR5 | P51681 | 1/20 | 0.36 |
| ▸ | LTC4S | Q16873 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | KIT | P10721 | 2/20 | 0.35 |
| ▸ | BRAF | P15056 | 2/20 | 0.35 |
| ▸ | KDR | P35968 | 2/20 | 0.35 |
| ▸ | FLT3 | P36888 | 2/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL12347487 | 0.90 | CYP2C9 (0.41) | CYP2C9CYP3A4GRM4CCR2KDM4E | |
| SCHEMBL14302510 | 0.85 | CYP2C9 (0.39) | CYP2C9CLCN2CYP3A4GRM4CCR2 | |
| SCHEMBL14303613 | 0.84 | CYP2C9 (0.43) | CYP2C9CYP3A4GRM4CCR2GLA | |
| SCHEMBL307486 | 0.80 | CYP2C9 (0.63) | CYP2C9CYP3A4CCR2CYP1A2CYP2D6 | |
| SCHEMBL14310292 | 0.79 | CDK8 (0.40) | CYP2C9GRM4KITBRAFKDR | |
| SCHEMBL13958200 | 0.77 | BRAF (0.49) | CYP2C9CYP3A4CCR2KITBRAF | |
| SCHEMBL306010 | 0.75 | CYP2C9 (0.46) | CYP2C9CYP3A4CCR2CYP1A2CYP2D6 | |
| SCHEMBL12593777 | 0.74 | AURKA (0.51) | CYP2C9CLCN2KDM4EKDR | |
| SCHEMBL12347533 | 0.73 | KDM4E (0.49) | CYP2C9GRM4HPGDCYP1A2CYP2D6 | |
| SCHEMBL14303603 | 0.73 | NR4A1 (0.48) | CYP2C9GRIK1CYP3A4CCR2CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2354126-A1 | Heteroaryl sulfonamides and CCR2 | ChemoCentryx, Inc. (US) | 2011-08-10 | — | — | EP | disclosed |