Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 5/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.38 |
| ▸ | BDKRB2 | P30411 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | SHBG | P04278 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | UBA1 | P22314 | 2/20 | 0.34 |
| ▸ | GPER1 | Q99527 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5325492 | 1.00 | CHRNB2 (0.39) | CHRNB2CHRNA4ESR1OPRM1BDKRB2 | |
| SCHEMBL28197625 | 1.00 | CHRNB2 (0.39) | CHRNB2CHRNA4ESR1OPRM1BDKRB2 | |
| Hydrochloric Acid SCHEMBL22574492 | 0.87 | OPRM1 (0.39) | OPRM1GAAMAPTOPRD1OPRK1 | |
| SCHEMBL28813162 | 0.81 | MAOA (0.46) | GAAMAPTALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL5131200 | 0.81 | MAOA (0.46) | GAAMAPTALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL8704991 | 0.81 | SHBG (0.40) | CHRNB2CHRNA4ESR1OPRM1BDKRB2 | |
| SCHEMBL8724857 | 0.81 | ALDH1A1 (0.44) | CHRNB2CHRNA4ESR1GAAALDH1A1 | |
| SCHEMBL8722537 | 0.80 | MAPT (0.51) | OPRM1GAAMAPTALDH1A1KDM4E | |
| SCHEMBL28197623 | 0.80 | MAPT (0.51) | OPRM1GAAMAPTALDH1A1KDM4E | |
| SCHEMBL31505403 | 0.79 | CHRNB2 (0.44) | CHRNB2CHRNA4ESR1OPRM1GAA |
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-1998056790-A1 | DIHYDROIMIDAZO[1,5-B]ISOQUINOLINE-1,3-DIONES AS APOPROTEIN B-100 INHIBITORS | GLAXO GROUP LIMITED (GB) | 1998-12-17 | — | — | WO | disclosed |