Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.47 |
| ▸ | SLC18A3 | Q16572 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 3/20 | 0.40 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.40 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | CCR5 | P51681 | 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 | |
|---|---|---|---|---|
| SCHEMBL4508734 | 0.81 | IDO1 (0.52) | SIGMAR1SLC18A3ALDH1A1LMNAKMT2A | |
| SCHEMBL2903219 | 0.76 | MAPT (0.51) | SIGMAR1SLC18A3ALDH1A1LMNAKMT2A | |
| SCHEMBL2903225 | 0.75 | ALDH1A1 (0.54) | ALDH1A1LMNAKMT2ADRD2DRD3 | |
| SCHEMBL2903456 | 0.70 | CCR2 (0.51) | ALDH1A1LMNAKMT2ADRD2DRD3 | |
| SCHEMBL2903457 | 0.70 | CCR2 (0.51) | ALDH1A1LMNAKMT2ADRD2DRD3 | |
| SCHEMBL4509129 | 0.69 | DRD2 (0.50) | SIGMAR1SLC18A3KMT2AHTR1AADRA1B | |
| SCHEMBL2903643 | 0.69 | CCR2 (0.61) | — | |
| SCHEMBL2903645 | 0.69 | CCR2 (0.61) | — | |
| SCHEMBL14587419 | 0.66 | SIGMAR1 (1.00) | SIGMAR1SLC18A3ALDH1A1LMNAGAA | |
| SCHEMBL2904849 | 0.64 | MEN1 (0.58) | ALDH1A1LMNAGAAKMT2AHPGD |
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-2010506-B1 | DIAZEPAN DERIVATIVES MODULATORS OF CHEMOKINE RECEPTORS | HOFFMANN LA ROCHE (CH) | 2010-08-04 | — | — | EP | disclosed |