Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 4/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11657607 | 0.86 | ALDH1A1 (0.36) | FAAHTSHRALDH1A1 | |
| SCHEMBL11659507 | 0.86 | TSHR (0.37) | FAAHCYP3A4TSHRALDH1A1MAPK1 | |
| SCHEMBL406807 | 0.81 | ALDH1A1 (0.40) | FAAHCHRM1AKR1A1CHRM3HTR2A | |
| SCHEMBL11779908 | 0.81 | FAAH (0.38) | FAAHTSHRLMNA | |
| SCHEMBL632803 | 0.77 | TSHR (0.42) | FAAHCHRM1AKR1A1CHRM3HTR2A | |
| SCHEMBL7113121 | 0.77 | HTR2C (0.36) | FAAHCHRM1AKR1A1CHRM3HTR2A | |
| SCHEMBL4958816 | 0.76 | TDP1 (0.39) | FAAHCHRM1AKR1A1CHRM3HTR2A | |
| SCHEMBL2381597 | 0.76 | MGAM (0.46) | FAAHCHRM1AKR1A1CHRM3HTR2A | |
| SCHEMBL21381332 | 0.75 | FAAH (0.50) | FAAHCNR1CNR2LMNAZDHHC7 | |
| SCHEMBL8422890 | 0.75 | FAAH (0.54) | FAAHCNR1CNR2LMNAALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4057643-A | Antifungal compositions of butanediol bis (chloroacetate) | CELANESE CORPORATION (US) | 1977-11-08 | — | — | US | claimed |
| US-4057643-A | Antifungal compositions of butanediol bis (chloroacetate) | CELANESE CORPORATION (US) | 1977-11-08 | — | — | US | disclosed |