Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 10/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.34 |
| ▸ | KIF11 | P52732 | 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 | |
|---|---|---|---|---|
| SCHEMBL6765644 | 0.71 | CHRM2 (0.60) | CCR2CHRM3CHRM2CYP2D6MAPK1 | |
| SCHEMBL18623050 | 0.70 | CHRM3 (0.54) | CCR2CHRM3CHRM2CYP2D6CHRM1 | |
| SCHEMBL6765350 | 0.69 | CCR2 (0.63) | CCR2CHRM2CYP2D6MAPK1CHRM1 | |
| SCHEMBL5061378 | 0.64 | KMT2A (0.56) | CHRM3CHRM2CYP2D6MAPK1CHRM1 | |
| SCHEMBL25698254 | 0.63 | HCRTR1 (0.47) | — | |
| SCHEMBL7808926 | 0.63 | KIF11 (0.47) | CCR2LMNAKIF11 | |
| SCHEMBL3576211 | 0.62 | CA1 (0.54) | — | |
| SCHEMBL2086686 | 0.62 | CA1 (0.54) | — | |
| SCHEMBL18632724 | 0.62 | ACHE (0.44) | CCR2CHRM3CHRM2CYP2D6CHRM1 | |
| SCHEMBL27803558 | 0.61 | CA1 (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997044329-A9 | DIARYLALKYL CYCLIC DIAMINE DERIVATIVES AS CHEMOKINE RECEPTOR ANTAGONISTS | — | 1998-03-12 | — | — | WO | disclosed |