Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 1/20 | 0.49 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.49 |
| ▸ | HTR6 | P50406 | 6/20 | 0.47 |
| ▸ | HTR2C | P28335 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | NMT1 | P30419 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | HTR1D | P28221 | 1/20 | 0.37 |
| ▸ | HTR1B | P28222 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8557186 | 0.83 | CHRM1 (0.49) | CHRM1CHRM3HTR6KMT2ACNR2 | |
| SCHEMBL8555011 | 0.82 | ALDH1A1 (0.51) | CHRM1CHRM3HTR6KMT2ACNR2 | |
| SCHEMBL21623806 | 0.78 | HTR6 (0.52) | HTR6HTR2CKMT2ACNR2HTR2A | |
| SCHEMBL6011372 | 0.77 | CHRM1 (0.44) | CHRM1CHRM3KMT2ACNR2NMT1 | |
| Hydrochloric Acid SCHEMBL6011621 | 0.75 | CHRM1 (0.43) | CHRM1CHRM3KMT2ACNR2NMT1 | |
| SCHEMBL6469248 | 0.75 | CHRM1 (0.45) | CHRM1CHRM3HTR2CKMT2ACNR2 | |
| SCHEMBL8171108 | 0.74 | ALDH1A1 (0.57) | CHRM1CHRM3HTR6KMT2ACNR2 | |
| SCHEMBL18025937 | 0.74 | HTR6 (0.46) | HTR6HTR2CKMT2AHTR2A | |
| SCHEMBL6469254 | 0.74 | CHRM1 (0.44) | CHRM1CHRM3KMT2ACNR2NMT1 | |
| SCHEMBL6011594 | 0.74 | CRBN (0.46) | CHRM1CHRM3HTR2CKMT2ACNR2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6114328-A | ANTICOAGULANTS; BLOOD DISORDERS | DUPONT PHARMACEUTICALS COMPANY (US) | 2000-09-05 | — | — | US | disclosed |
| US-5849736-A | Isoxazoline and isoxazole fibrinogen receptor antagonists | THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) | 1998-12-15 | — | — | US | disclosed |
| EP-0832076-A1 | NOVEL ISOXAZOLINE AND ISOXAZOLE FIBRINOGEN RECEPTOR ANTAGONISTS | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1998-04-01 | — | — | EP | disclosed |