Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.37 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | GPR3 | P46089 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | GLA | P06280 | 2/20 | 0.35 |
| ▸ | CASP1 | P29466 | 2/20 | 0.35 |
| ▸ | CASP7 | P55210 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | NQO2 | P16083 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | DRD1 | P21728 | 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 | |
|---|---|---|---|---|
| SCHEMBL11919171 | 0.79 | PTGS1 (0.46) | CYP1A2IDO1GPR3ALDH1A1HPGD | |
| SCHEMBL5044710 | 0.79 | ELANE (0.41) | LOXL2CYP1A2IDO1GPR3ALDH1A1 | |
| SCHEMBL8772908 | 0.76 | ALDH1A1 (0.37) | IDO1GPR3ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL2920597 | 0.76 | CA2 (0.54) | IDO1GPR3ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL8772757 | 0.75 | ALDH1A1 (0.37) | IDO1GPR3ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL1027461 | 0.73 | SMN1; SMN2 (0.43) | ALDH1A1HPGDSMN1; SMN2KDM4EGLA | |
| SCHEMBL2493164 | 0.73 | PARP1 (0.43) | CYP1A2ALDH1A1HPGDSMN1; SMN2KDM4E | |
| SCHEMBL3229873 | 0.73 | LMNA (0.40) | CYP1A2GPR3ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL5298071 | 0.72 | MAOB (0.39) | GPR3ALDH1A1HPGDSMN1; SMN2HSD17B10 | |
| SCHEMBL7155004 | 0.72 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2KDM4EGLAHSD17B10 |
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-1317459-A1 | BICYCLIC PYRROLYL AMIDES AS GLUCOGEN PHOSPHORYLASE INHIBITORS | AstraZeneca AB (SE) | 2003-06-11 | — | — | EP | disclosed |
| WO-2002020530-A1 | BICYCLIC PYRROLYL AMIDES AS GLUCOGEN PHOSPHORYLASE INHIBITORS | ASTRAZENECA AB (SE) | 2002-03-14 | — | — | WO | disclosed |