Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABBR2 | O75899 | 2/20 | 0.54 |
| ▸ | GABBR1 | Q9UBS5 | 2/20 | 0.54 |
| ▸ | HMGCR | P04035 | 2/20 | 0.45 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.45 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.45 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 2/20 | 0.39 |
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | EEF2K | O00418 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6918935 | 0.88 | GABBR2 (0.50) | GABBR2GABBR1HMGCRGPR55NR1I2 | |
| SCHEMBL6918934 | 0.88 | GABBR2 (0.50) | GABBR2GABBR1HMGCRGPR55NR1I2 | |
| SCHEMBL6909695 | 0.86 | TNFRSF1A (0.46) | GABBR2GABBR1HMGCRGPR55NR1I2 | |
| SCHEMBL6918142 | 0.83 | GABBR2 (0.59) | GABBR2GABBR1HMGCRGPR55NR1I2 | |
| SCHEMBL6910438 | 0.81 | GABBR2 (0.60) | GABBR2GABBR1HMGCRGPR55NR1I2 | |
| SCHEMBL7065247 | 0.81 | GABBR2 (0.50) | GABBR2GABBR1HMGCRGPR55NR1I2 | |
| SCHEMBL7065244 | 0.81 | GABBR2 (0.50) | GABBR2GABBR1HMGCRGPR55NR1I2 | |
| SCHEMBL10001168 | 0.78 | GABBR2 (0.68) | GABBR2GABBR1GPR55TNFRSF1APTGS1 | |
| SCHEMBL6910433 | 0.77 | TNFRSF1A (0.45) | GABBR2GABBR1HMGCRGPR55NR1I2 | |
| SCHEMBL6910432 | 0.77 | TNFRSF1A (0.45) | GABBR2GABBR1HMGCRGPR55NR1I2 |
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-2004026245-A2 | SUBSTITUTED PHOSPHONATE COMPOUNDS HAVING BONE ANABOLIC ACTIVITY | ILEX ONCOLOGY RESEARCH, SARL (CH) | 2004-04-01 | — | — | WO | disclosed |