Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.35 |
| ▸ | MGAM | O43451 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | SI | P14410 | 1/20 | 0.34 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.34 |
| ▸ | NAAA | Q02083 | 2/20 | 0.34 |
| ▸ | UGT2B7 | P16662 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3654740 | 0.83 | CYP2D6 (0.61) | CYP2D6TSHRKMT2AALDH1A1NPSR1 | |
| SCHEMBL1245676 | 0.82 | CYP2D6 (0.60) | CYP2D6TSHRKMT2AALDH1A1NPSR1 | |
| SCHEMBL2216450 | 0.81 | CYP2D6 (0.51) | CYP2D6TSHRKMT2AALDH1A1NPSR1 | |
| SCHEMBL1245653 | 0.76 | CYP2D6 (0.56) | CYP2D6TSHRKMT2AALDH1A1NPSR1 | |
| SCHEMBL14975944 | 0.74 | NPSR1 (0.38) | TSHRALDH1A1NPSR1NAAA | |
| SCHEMBL1866738 | 0.73 | CYP2D6 (0.47) | CYP2D6TSHRKMT2AALDH1A1NPSR1 | |
| SCHEMBL22963812 | 0.73 | CYP2D6 (0.47) | CYP2D6TSHRKMT2AALDH1A1NPSR1 | |
| SCHEMBL5682017 | 0.73 | CYP2D6 (0.47) | CYP2D6TSHRKMT2AALDH1A1NPSR1 | |
| SCHEMBL13681637 | 0.73 | CYP2D6 (0.47) | CYP2D6TSHRKMT2AALDH1A1NPSR1 | |
| SCHEMBL27545267 | 0.73 | CYP2D6 (0.47) | CYP2D6TSHRKMT2AALDH1A1NPSR1 |
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-6344471-B1 | DIISOPROPYL FLUOROPHOSPHATE (DFP), TREATMENT OF COGNITIVE DISORDERS, DEPRESSION, SCHIZOPHRENIA AND ANXIETY. | BAYER AKTIENGESELLSCHAFT (DE) | 2002-02-05 | — | — | US | disclosed |