Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VDR | P11473 | 11/20 | 0.86 |
| ▸ | MAPT | P10636 | 3/20 | 0.86 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.86 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.86 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.86 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.86 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.86 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.86 |
| ▸ | GC | P02774 | 1/20 | 0.86 |
| ▸ | PGR | P06401 | 1/20 | 0.86 |
| ▸ | RXRA | P19793 | 1/20 | 0.86 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.86 |
| ▸ | CNR1 | P21554 | 1/20 | 0.86 |
| ▸ | HTR2C | P28335 | 1/20 | 0.86 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.86 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.86 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.86 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.86 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.86 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.86 |
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 | |
|---|---|---|---|---|
| SCHEMBL9722585 | 1.00 | VDR (0.86) | VDRMAPTADORA3SLC6A2AGTR1 | |
| SCHEMBL10445242 | 1.00 | VDR (0.86) | VDRMAPTADORA3SLC6A2AGTR1 | |
| SCHEMBL11165113 | 1.00 | VDR (0.86) | VDRMAPTADORA3SLC6A2AGTR1 | |
| SCHEMBL10892411 | 1.00 | VDR (0.86) | VDRMAPTADORA3SLC6A2AGTR1 | |
| SCHEMBL10895773 | 1.00 | VDR (0.86) | VDRMAPTADORA3SLC6A2AGTR1 | |
| SCHEMBL23359068 | 1.00 | VDR (0.86) | VDRMAPTADORA3SLC6A2AGTR1 | |
| SCHEMBL9722594 | 1.00 | VDR (0.86) | VDRMAPTADORA3SLC6A2AGTR1 | |
| SCHEMBL9173699 | 1.00 | VDR (0.86) | VDRMAPTADORA3SLC6A2AGTR1 | |
| SCHEMBL9722605 | 1.00 | VDR (0.86) | VDRMAPTADORA3SLC6A2AGTR1 | |
| SCHEMBL10892402 | 1.00 | VDR (0.86) | VDRMAPTADORA3SLC6A2AGTR1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-58210017-A | — | — | None | — | — | JP | disclosed |
| WO-2023068322-A1 | CD RING SIDE CHAIN-SUBSTITUTED VITAMIN D DERIVATIVE | 学校法人帝京大学 | 2023-04-27 | — | — | WO | disclosed |
| US-5120722-A | Trihydroxy-cholecacliferol and trihydroxy-ergocalciferol for treating leukemia | HOFFMANN-LA ROCHE INC. (US) | 1992-06-09 | — | — | US | disclosed |
| US-5110958-A | Antitumor agents | HOFFMANN-LA ROCHE INC. (US) | 1992-05-05 | — | — | US | disclosed |
| EP-0154185-B1 | CALCIFEROL DERIVATIVES | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1988-10-05 | — | — | EP | disclosed |
| US-4749710-A | HYDROXYLATED ERGOCALCIFEROLS; ADMINISTERING | HOFFMANN-LA ROCHE INC. (US) | 1988-06-07 | — | — | US | disclosed |
| US-4617297-A | CALCIUM METABOLIC DISORDERS | HOFFMANN-LA ROCHE INC. (US) | 1986-10-14 | — | — | US | disclosed |
| JP-S58210017-A | ANTITUMOR AGENT | KUREHA CHEM IND CO LTD | 1983-12-07 | — | — | JP | disclosed |