Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | BCL2A1 | Q16548 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | PTGIR | P43119 | 2/20 | 0.35 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 4/20 | 0.34 |
| ▸ | HTT | P42858 | 3/20 | 0.34 |
| ▸ | NPC1 | O15118 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1924545 | 0.79 | LTB4R2 (0.51) | LTB4R2RAB9AHTTNPC1ALDH1A1 | |
| SCHEMBL3772650 | 0.77 | MT-CO2 (0.36) | LTB4R2CES2CES1PTGIRPTGDR | |
| SCHEMBL11287043 | 0.72 | ALDH1A1 (0.58) | CYP3A4RAB9AHTTNPC1ALDH1A1 | |
| SCHEMBL2094710 | 0.72 | CES2 (0.42) | LTB4R2CES2CES1PTGIRPTGDR | |
| SCHEMBL12497870 | 0.70 | CYP3A4 (0.45) | CYP3A4PTGIRRAB9AHTTNPC1 | |
| SCHEMBL2092753 | 0.69 | PTGIR (0.49) | LTB4R2CES2CES1PTGIRPTGDR | |
| SCHEMBL12497756 | 0.69 | ALDH1A1 (0.46) | CYP3A4PTGIRRAB9ANPC1ALDH1A1 | |
| SCHEMBL16701743 | 0.68 | TDP1 (0.44) | RAB9AHTTNPC1ALDH1A1SMN1; SMN2 | |
| SCHEMBL6830331 | 0.68 | HTT (0.55) | LTB4R2RAB9AHTTNPC1ALDH1A1 | |
| SCHEMBL688212 | 0.68 | CES2 (0.38) | LTB4R2CES2CES1PTGIRPTGDR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2250157-A1 | NOVEL HETEROCYCLIC COMPOUNDS | Panacea Biotec Limited (IN) | 2010-11-17 | — | — | EP | disclosed |
| WO-2009093269-A1 | NOVEL HETEROCYCLIC COMPOUNDS | PANACEA BIOTEC LIMITED (IN) | 2009-07-30 | — | — | WO | disclosed |