Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 7/20 | 0.58 |
| ▸ | CES1 | P23141 | 2/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | SOAT1 | P35610 | 2/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | TERT | O14746 | 3/20 | 0.51 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.51 |
| ▸ | PPARG | P37231 | 3/20 | 0.51 |
| ▸ | PPARD | Q03181 | 3/20 | 0.51 |
| ▸ | PPARA | Q07869 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | BLM | P54132 | 2/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | FABP4 | P15090 | 2/20 | 0.51 |
| ▸ | GMNN | O75496 | 1/20 | 0.51 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL28846296 | 0.91 | FAAH (0.50) | FAAHCES1CYP1A2KMT2AMEN1 | |
| Bromide SCHEMBL5158748 | 0.83 | FAAH (0.49) | FAAHCES1CYP1A2CYP2C19KMT2A | |
| SCHEMBL9212159 | 0.82 | FAAH (0.67) | FAAHCES1CYP1A2CYP2C19KMT2A | |
| SCHEMBL869143 | 0.82 | FAAH (0.67) | FAAHCES1CYP1A2CYP2C19KMT2A | |
| SCHEMBL21751441 | 0.82 | FAAH (0.67) | FAAHCES1CYP1A2CYP2C19KMT2A | |
| SCHEMBL7041022 | 0.81 | FAAH (0.61) | FAAHCES1CYP1A2CYP2C19KMT2A | |
| SCHEMBL4408909 | 0.81 | FAAH (0.61) | FAAHCES1CYP1A2CYP2C19KMT2A | |
| Bromide SCHEMBL28986423 | 0.81 | FAAH (0.65) | FAAHCES1CYP1A2CYP2C19KMT2A | |
| SCHEMBL28610213 | 0.81 | FAAH (0.65) | FAAHCES1CYP1A2CYP2C19KMT2A | |
| SCHEMBL8655383 | 0.80 | FAAH (0.69) | FAAHCES1CYP1A2CYP2C19KMT2A |
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-0165630-B1 | METHOD OF PREPARING A CHLORINATED, BROMINATED, RADIOBROMINATED, IODINATED AND/OR RADIOIODINATED, AROMATIC OR HETEROAROMATIC COMPOUND, AS WELL AS A KIT FOR PREPARING A DIAGNOSTIC COMPOSITION ON THE BASIS OF THIS COMPOUND | MALLINCKRODT, INC.(a Missouri corporation) (US) | 1989-10-18 | — | — | EP | claimed |