Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 5/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.33 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.33 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29091934 | 0.92 | HRH3 (0.41) | ESR2POLBDRD2HRH3KCNH2 | |
| SCHEMBL19864914 | 0.91 | ESR2 (0.52) | ESR2SLC6A2SLC6A4SLC6A3POLB | |
| SCHEMBL8849454 | 0.90 | HRH3 (0.44) | ESR2POLBHRH3KCNH2HAO1 | |
| SCHEMBL27835366 | 0.90 | HRH3 (0.44) | ESR2POLBHRH3KCNH2HAO1 | |
| SCHEMBL20003490 | 0.86 | ESR2 (0.47) | ESR2SLC6A2SLC6A4SLC6A3DRD2 | |
| SCHEMBL21482405 | 0.80 | STS (0.44) | MRGPRX4 | |
| SCHEMBL24787 | 0.78 | CA1 (0.32) | CYP3A4 | |
| SCHEMBL20734709 | 0.76 | MEN1 (0.33) | ESR2 | |
| SCHEMBL16383173 | 0.72 | NR3C1 (0.38) | — | |
| SCHEMBL2884020 | 0.72 | ESR2 (0.57) | ESR2POLBCYP3A4CYP2C9ESR1 |
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-5442039-A | Rod-like mesogenic structures incorporated into polytriazine products; improved tensile strength, flexural strength | THE DOW CHEMICAL COMPANY (US) | 1995-08-15 | — | — | US | disclosed |
| US-5428125-A | Liquid crystalline | THE DOW CHEMICAL COMPANY (US) | 1995-06-27 | — | — | US | disclosed |