Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPY5R | Q15761 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 2/20 | 0.35 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.35 |
| ▸ | CCR5 | P51681 | 2/20 | 0.35 |
| ▸ | TACR2 | P21452 | 1/20 | 0.35 |
| ▸ | TACR1 | P25103 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL737191 | 0.92 | NPY5R (0.36) | NPY5RHTR1AADAMTS5CCR5TACR2 | |
| SCHEMBL737190 | 0.92 | NPY5R (0.36) | NPY5RHTR1AADAMTS5CCR5TACR2 | |
| SCHEMBL13495289 | 0.86 | MAPT (0.40) | HTR1AADAMTS5HIF1AMAPTMAPK1 | |
| SCHEMBL736078 | 0.84 | HTR1A (0.37) | HTR1AADAMTS5TACR2TACR1HIF1A | |
| SCHEMBL736077 | 0.84 | HTR1A (0.37) | HTR1AADAMTS5TACR2TACR1HIF1A | |
| SCHEMBL13495283 | 0.84 | ADAMTS5 (0.38) | HTR1AADAMTS5HIF1AMAPTMAPK1 | |
| SCHEMBL734831 | 0.81 | HTR1A (0.35) | HTR1AADAMTS5TACR2TACR1HIF1A | |
| SCHEMBL734830 | 0.81 | HTR1A (0.35) | HTR1AADAMTS5TACR2TACR1HIF1A | |
| SCHEMBL737154 | 0.80 | HTR1A (0.40) | HTR1AADAMTS5HIF1AMAPTMAPK1 | |
| SCHEMBL737155 | 0.80 | HTR1A (0.40) | HTR1AADAMTS5HIF1AMAPTMAPK1 |
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-2010012619-A1 | DIAZEPAN AND PIPERAZINE DERIVATIVES MODULATORS OF CHEMOKINE RECEPTORS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-02-04 | — | — | WO | disclosed |