Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 7/20 | 0.58 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.58 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.58 |
| ▸ | MAOB | P27338 | 4/20 | 0.57 |
| ▸ | MAOA | P21397 | 1/20 | 0.57 |
| ▸ | LCK | P06239 | 1/20 | 0.54 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.53 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.51 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.51 |
| ▸ | CDK1 | P06493 | 1/20 | 0.51 |
| ▸ | CDK4 | P11802 | 1/20 | 0.51 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.51 |
| ▸ | CCND1 | P24385 | 1/20 | 0.51 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL28567450 | 0.86 | ALDH1A1 (0.60) | BCHEMAOBALDH1A1RAB9A | |
| SCHEMBL13859154 | 0.84 | MAOB (0.64) | BCHECYP4F2CYP4A11MAOBMAOA | |
| SCHEMBL1009475 | 0.84 | MAOB (0.68) | BCHECYP4F2CYP4A11MAOBMAOA | |
| SCHEMBL11127858 | 0.84 | ALDH1A1 (0.42) | BCHECYP4F2CYP4A11MAOBMAOA | |
| SCHEMBL7489763 | 0.83 | MAOB (0.62) | BCHECYP4F2CYP4A11MAOBMAOA | |
| SCHEMBL30083980 | 0.82 | LMNA (0.58) | BCHEMAOBMAOANR4A2ALDH1A1 | |
| SCHEMBL2093704 | 0.82 | ALDH1A1 (0.41) | BCHECYP4F2CYP4A11MAOBMAOA | |
| SCHEMBL2318952 | 0.82 | KDM4E (0.50) | BCHEKDM4EMEN1ALDH1A1GAA | |
| SCHEMBL30083990 | 0.82 | ALDH1A1 (0.46) | MAOBKDM4EMEN1ALDH1A1KMT2A | |
| SCHEMBL7806003 | 0.82 | ALDH1A1 (0.46) | MAOBKDM4EMEN1ALDH1A1KMT2A |
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-1994000432-A1 | ANORECTIC EPINEPHRINE DERIVATIVES | THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 1994-01-06 | — | — | WO | disclosed |