Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VDR | P11473 | 9/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.48 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.48 |
| ▸ | PGR | P06401 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.48 |
| ▸ | CYP24A1 | Q07973 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | AR | P10275 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8927148 | 1.00 | VDR (0.52) | VDRADRA1AADORA3SLC6A2NR1I2 | |
| SCHEMBL8616073 | 0.86 | VDR (0.67) | VDRADRA1AADORA3SLC6A2NR1I2 | |
| SCHEMBL8743919 | 0.85 | VDR (0.49) | VDRADRA1AADORA3SLC6A2NR1I2 | |
| SCHEMBL8616823 | 0.85 | VDR (0.49) | VDRADRA1AADORA3SLC6A2NR1I2 | |
| SCHEMBL8613230 | 0.84 | VDR (0.57) | VDRADRA1AADORA3SLC6A2NR1I2 | |
| SCHEMBL8973892 | 0.83 | VDR (0.51) | VDRADRA1AADORA3SLC6A2NR1I2 | |
| SCHEMBL3682199 | 0.83 | VDR (0.72) | VDRADRA1AADORA3SLC6A2NR1I2 | |
| SCHEMBL8971842 | 0.81 | VDR (0.57) | VDRADRA1AADORA3SLC6A2NR1I2 | |
| SCHEMBL8963804 | 0.81 | VDR (0.50) | VDRADRA1AADORA3SLC6A2NR1I2 | |
| SCHEMBL8397635 | 0.81 | VDR (0.50) | VDRADRA1AADORA3SLC6A2NR1I2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5686435-A | Vitamin D amide derivatives | RESEARCH INSTITUTE FOR MEDICINE AND CHEMISTRY (US) | 1997-11-11 | — | — | US | disclosed |
| EP-0614455-B1 | VITAMIN D AMIDE DERIVATIVES | RES INST MEDICINE CHEM (US) | 1996-02-21 | — | — | EP | disclosed |
| WO-1993009093-A1 | VITAMIN D AMIDE DERIVATIVES | HOLMES, MICHAEL, JOHN (GB) | 1993-05-13 | — | — | WO | disclosed |