Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 6/20 | 0.44 |
| ▸ | MAOB | P27338 | 6/20 | 0.44 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | AKT1 | P31749 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4566671 | 0.79 | MAOA (0.44) | MAOAMAOBCES2CES1EGFR | |
| SCHEMBL18570451 | 0.78 | MAOA (0.44) | MAOAMAOBMTNR1AMTNR1B | |
| SCHEMBL30680 | 0.76 | MAOA (0.48) | MAOAMAOBLMNAAKT1 | |
| SCHEMBL10507643 | 0.75 | MAPT (0.52) | MTNR1AMTNR1BCES2CES1LMNA | |
| SCHEMBL2380219 | 0.75 | MAOA (0.44) | MAOAMAOBEGFRLMNAAKT1 | |
| SCHEMBL3031432 | 0.75 | MAOA (0.44) | MAOAMAOBEGFRLMNAAKT1 | |
| Charcoal, Activated SCHEMBL9723289 | 0.74 | MAOA (0.47) | MAOAMAOBLMNAAKT1 | |
| Water SCHEMBL8670864 | 0.74 | MAOA (0.47) | MAOAMAOBLMNAAKT1 | |
| SCHEMBL18546613 | 0.74 | MAOA (0.47) | MAOAMAOBCES2CES1EGFR | |
| SCHEMBL8163848 | 0.73 | MAOA (0.42) | MAOAMAOBCES2CES1EGFR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102438619-A | Isoprenylated bisphosphonates as antituberculosis agents | UNIV IOWA RES FOUND | 2012-05-02 | — | — | CN | disclosed |
| US-4982034-A | ALKYLATION, OXIDATIVE DEHYDROGENATION, DISTILLATION, EVAPORATION, ADSORPTION | AMOCO CORPORATION (US) | 1991-01-01 | — | — | US | disclosed |