Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.37 |
| ▸ | BCL2A1 | Q16548 | 1/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 5/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 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 | |
|---|---|---|---|---|
| SCHEMBL5284805 | 0.93 | ALDH1A1 (0.39) | ALDH1A1POLBCHRM2CHRM1OPRM1 | |
| SCHEMBL5279342 | 0.92 | EPHX2 (0.36) | ALDH1A1POLBCHRM2CHRM1OPRM1 | |
| SCHEMBL5280465 | 0.92 | EPHX2 (0.36) | ALDH1A1POLBCHRM2CHRM1OPRM1 | |
| SCHEMBL5280454 | 0.92 | EPHX2 (0.36) | ALDH1A1POLBCHRM2CHRM1OPRM1 | |
| SCHEMBL5274263 | 0.91 | ALDH1A1 (0.40) | ALDH1A1POLBCHRM2CHRM1OPRM1 | |
| SCHEMBL5178320 | 0.91 | KDM4E (0.36) | ALDH1A1POLBOPRM1EPHX2BCL2A1 | |
| SCHEMBL966775 | 0.91 | ALDH1A1 (0.44) | ALDH1A1POLBCHRM2CHRM1OPRM1 | |
| SCHEMBL5178798 | 0.86 | KDM4E (0.42) | ALDH1A1POLBOPRM1 | |
| SCHEMBL5164103 | 0.86 | ALDH1A1 (0.43) | ALDH1A1POLBCHRM2CHRM1OPRM1 | |
| SCHEMBL5278268 | 0.85 | EPHX2 (0.36) | ALDH1A1POLBOPRM1EPHX2P2RX7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1768973-B1 | SUBSTITUTED QUINOLONES | AICURIS GMBH & CO KG (DE) | 2007-12-05 | — | — | EP | disclosed |