Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 2/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.37 |
| ▸ | CYP51A1 | Q16850 | 5/20 | 0.37 |
| ▸ | PYGL | P06737 | 3/20 | 0.37 |
| ▸ | PYGM | P11217 | 1/20 | 0.37 |
| ▸ | STAT6 | P42226 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 2/20 | 0.36 |
| ▸ | DRD3 | P35462 | 2/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | DRD1 | P21728 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | DRD5 | P21918 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | CCKAR | P32238 | 1/20 | 0.35 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19856912 | 1.00 | ESR1 (0.40) | ESR1DRD2MCHR1CYP51A1PYGL | |
| SCHEMBL19856946 | 0.94 | DRD2 (0.38) | ESR1DRD2MCHR1CYP51A1PYGL | |
| SCHEMBL19856948 | 0.94 | DRD2 (0.38) | ESR1DRD2MCHR1CYP51A1PYGL | |
| SCHEMBL19856882 | 0.91 | ALOX15 (0.42) | DRD2CYP51A1PYGLSTAT6DRD3 | |
| SCHEMBL19856883 | 0.91 | ALOX15 (0.42) | DRD2CYP51A1PYGLSTAT6DRD3 | |
| SCHEMBL19856872 | 0.91 | DRD2 (0.41) | DRD2CYP51A1PYGLSTAT6ALOX15 | |
| SCHEMBL19856871 | 0.91 | DRD2 (0.41) | DRD2CYP51A1PYGLSTAT6ALOX15 | |
| SCHEMBL19856942 | 0.90 | DRD2 (0.42) | DRD2CYP51A1PYGLSTAT6HTR2C | |
| SCHEMBL19856943 | 0.90 | DRD2 (0.42) | DRD2CYP51A1PYGLSTAT6HTR2C | |
| SCHEMBL19856914 | 0.88 | CYP51A1 (0.40) | DRD2CYP51A1PYGLSTAT6ALOX15 |
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-2925857-B1 | USE OF TRPV4 ANTAGONISTS TO AMELIORATE HYDROCEPHALUS AND RELATED MATERIALS AND METHODS | UNIV INDIANA RES & TECH CORP (US) | 2018-02-14 | — | — | EP | claimed |