Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | CTSC | P53634 | 1/20 | 0.32 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.32 |
| ▸ | PIM1 | P11309 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL949192 | 1.00 | EPHX2 (0.36) | EPHX2CHRNB2CHRNA4KDM4EALDH1A1 | |
| SCHEMBL31439838 | 1.00 | EPHX2 (0.36) | EPHX2CHRNB2CHRNA4KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL7316491 | 0.98 | EPHX2 (0.35) | EPHX2CHRNB2CHRNA4KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL949191 | 0.98 | EPHX2 (0.35) | EPHX2CHRNB2CHRNA4KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL949193 | 0.98 | EPHX2 (0.35) | EPHX2CHRNB2CHRNA4KDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL949189 | 0.98 | EPHX2 (0.35) | EPHX2CHRNB2CHRNA4KDM4EALDH1A1 | |
| SCHEMBL7340976 | 0.83 | CYP1A2 (0.43) | EPHX2KDM4E | |
| SCHEMBL7340974 | 0.83 | CYP1A2 (0.43) | EPHX2KDM4E | |
| SCHEMBL7864760 | 0.83 | CYP1A2 (0.43) | EPHX2KDM4E | |
| SCHEMBL13809125 | 0.81 | CHRNB2 (0.37) | CHRNB2CHRNA4KDM4EALDH1A1CHRNB4 |
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-0115091-A1 | N-carboxyacyl derivatives of cyclic amino acids, useful as antihypertensives | ENI-Ente Nazionale Idrocarburi (IT) | 1984-08-08 | — | — | EP | disclosed |