Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | 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 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 3/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL31266607 | 0.87 | CA1 (0.42) | TDP1TSHRCYP3A4CA1ABCB1 | |
| SCHEMBL27872215 | 0.86 | CHRM1 (0.36) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| SCHEMBL10794165 | 0.85 | CA1 (0.48) | CA1ABCB1FAAHMAPTLMNA | |
| SCHEMBL15169702 | 0.84 | FAAH (0.47) | CA1ABCB1FAAHMAPTLMNA | |
| SCHEMBL31665917 | 0.83 | CHRM1 (0.33) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| SCHEMBL4530674 | 0.82 | CTSK (0.40) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| SCHEMBL4530794 | 0.82 | FAAH (0.44) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| Ethyl Acetate SCHEMBL9473456 | 0.82 | ALDH1A1 (0.42) | TSHRFAAHLMNA | |
| SCHEMBL3460923 | 0.81 | TSHR (0.43) | TSHRCA1MAPTLMNACA2 | |
| SCHEMBL629384 | 0.80 | TSHR (0.39) | CHRM1AKR1A1CHRM3HTR2AHTR2C |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0515231-B1 | Biodegradable fish bait made of polyester-polyurethanes | HAMPSHIRE CHEMICAL CORP (US) | 1996-11-13 | — | — | EP | disclosed |
| US-5270044-A | Polyesterurethane, polyoxyethylene glycol, CMC | HAMPSHIRE CHEMICAL CORP. (US) | 1993-12-14 | — | — | US | disclosed |
| US-5266323-A | Polyurethanes | HAMPSHIRE CHEMICAL CORP. (US) | 1993-11-30 | — | — | US | disclosed |
| EP-0515231-A2 | Biodegradable fish bait made of polyester-polyurethanes | HAMPSHIRE CHEMICAL CORPORATION (US) | 1992-11-25 | — | — | EP | disclosed |