Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | BLM | P54132 | 2/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | ABAT | P80404 | 1/20 | 0.36 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.35 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.31 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.31 |
| ▸ | SLC1A1 | P43005 | 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 | |
|---|---|---|---|---|
| SCHEMBL9773132 | 1.00 | CYP2D6 (0.48) | CYP2D6LMNABLMALOX15CYP1A2 | |
| SCHEMBL4021043 | 0.81 | CYP2D6 (0.45) | CYP2D6LMNABLMALOX15CYP1A2 | |
| SCHEMBL10738339 | 0.81 | CYP2D6 (0.45) | CYP2D6LMNABLMALOX15CYP1A2 | |
| SCHEMBL10742978 | 0.81 | CYP2D6 (0.45) | CYP2D6LMNABLMALOX15CYP1A2 | |
| SCHEMBL10860229 | 0.81 | CYP2D6 (0.45) | CYP2D6LMNABLMALOX15CYP1A2 | |
| Hydrochloric Acid SCHEMBL6120321 | 0.81 | MBTD1 (0.33) | CYP2D6LMNABLMALOX15CYP1A2 | |
| Hydrochloric Acid SCHEMBL4616904 | 0.80 | CYP2D6 (0.43) | CYP2D6LMNABLMALOX15CYP1A2 | |
| SCHEMBL9627515 | 0.73 | ABAT (0.30) | ABAT | |
| SCHEMBL10588604 | 0.73 | ABAT (0.30) | ABAT | |
| SCHEMBL9626802 | 0.73 | ABAT (0.30) | ABAT |
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 |
|---|---|---|---|---|---|---|---|
| US-4920144-A | Derivatives of bicyclic amino acids, agents containing them and their use as hypotensives | HOECHST AKTIENGESELLSCHAFT (DE) | 1990-04-24 | — | — | US | disclosed |