Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 4/20 | 0.58 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | COMT | P21964 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | BRD2 | P25440 | 1/20 | 0.43 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.43 |
| ▸ | PRKCA | P17252 | 2/20 | 0.43 |
| ▸ | GSK3B | P49841 | 2/20 | 0.43 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.43 |
| ▸ | FEN1 | P39748 | 1/20 | 0.43 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.42 |
| ▸ | ALKBH3 | Q96Q83 | 1/20 | 0.42 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.42 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL14118224 | 0.77 | CD274 (0.60) | BRD4ALDH1A1LMNAHDAC4HDAC8 | |
| SCHEMBL29848894 | 0.73 | BRD4 (1.00) | BRD4BRD9BRD2PRKCAGSK3B | |
| SCHEMBL21157339 | 0.73 | BRD4 (0.48) | BRD4GRM2ALDH1A1LMNAHDAC4 | |
| SCHEMBL16650880 | 0.73 | BRD4 (1.00) | BRD4BRD9BRD2PRKCAGSK3B | |
| SCHEMBL163034 | 0.73 | CD274 (0.52) | BRD4ALDH1A1LMNACD274KCNA3 | |
| SCHEMBL4200639 | 0.71 | CYP1A1 (0.56) | ALDH1A1LMNACD274 | |
| SCHEMBL28432958 | 0.71 | CYP1A1 (0.51) | BRD4ALDH1A1LMNAHDAC4HDAC8 | |
| SCHEMBL18002967 | 0.70 | ERN1 (0.52) | BRD4ALDH1A1LMNAHDAC4HDAC8 | |
| SCHEMBL22604744 | 0.70 | BRD4 (0.60) | BRD4GRM2ALDH1A1LMNABRD9 | |
| SCHEMBL2020140 | 0.69 | ABL1 (0.59) | BRD4ALDH1A1LMNAHDAC4HDAC8 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4435572-A | FROM 3-METHOXYBENZALDEHYDE | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 1984-03-06 | — | — | US | disclosed |
| US-4346224-A | MORPHINE ANALOGS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 1982-08-24 | — | — | US | disclosed |
| US-4289882-A | MORPHINE ANALOG ANALGESICS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH & HUMAN SERVICES (US) | 1981-09-15 | — | — | US | disclosed |
| US-4189583-A | FROM 1-METHYL-2-OXO-3-METHYLENE-4-(3'-METHOXYPHENYL)-4 -(CARBOXYMETHYLENE)PIPERIDINE BY CYCLIZATION | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH, EDUCATION AND WELFARE (US) | 1980-02-19 | — | — | US | disclosed |