Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 3/20 | 0.34 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.34 |
| ▸ | NPBWR1 | P48145 | 2/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.33 |
| ▸ | IDH1 | O75874 | 2/20 | 0.33 |
| ▸ | ESRRA | P11474 | 1/20 | 0.32 |
| ▸ | MDM4 | O15151 | 3/20 | 0.32 |
| ▸ | MDM2 | Q00987 | 3/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 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 | |
|---|---|---|---|---|
| SCHEMBL6777360 | 0.87 | OPRM1 (0.39) | OPRM1NPBWR1MCHR1FAAHMEN1 | |
| SCHEMBL6771336 | 0.86 | CCNA2 (0.37) | OPRM1P2RX3NPBWR1MCHR1IDH1 | |
| SCHEMBL6770531 | 0.86 | MEN1 (0.40) | OPRM1MEN1LMNACYP1A2CYP3A4 | |
| SCHEMBL6771211 | 0.83 | MEN1 (0.34) | OPRM1MEN1LMNACYP1A2CYP3A4 | |
| SCHEMBL6770141 | 0.83 | PTGS1 (0.41) | OPRM1NPBWR1MCHR1MEN1LMNA | |
| SCHEMBL6766535 | 0.82 | DHODH (0.36) | OPRM1ESRRAMEN1LMNACYP1A2 | |
| SCHEMBL6767179 | 0.82 | POLB (0.35) | OPRM1MEN1LMNACYP1A2CYP3A4 | |
| SCHEMBL6771166 | 0.81 | OPRM1 (0.32) | OPRM1NPBWR1MCHR1MEN1LMNA | |
| SCHEMBL6770382 | 0.81 | MEN1 (0.34) | OPRM1NPBWR1MCHR1MEN1LMNA | |
| SCHEMBL6165463 | 0.77 | RAB9A (0.41) | P2RX3MEN1LMNAHTTKMT2A |
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-6716856-B1 | CELL PROLIFERATIVE DISORDERS OR ALZHEIMER'S DISEASE; REDUCED TOXICITY; CDK/CYCLIN KINASE INHIBITORY ACTIVITY | PHARMACIA & TUBJOHN SPA (IT) | 2004-04-06 | — | — | US | disclosed |