Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL25450429 | 0.84 | OPRM1 (0.32) | TSHRCYP2C9CYP2C19 | |
| SCHEMBL10013223 | 0.84 | OPRM1 (0.32) | TSHRCYP2C9CYP2C19 | |
| SCHEMBL8728482 | 0.81 | — | — | |
| SCHEMBL26906347 | 0.76 | TSHR (0.33) | TSHR | |
| SCHEMBL13232053 | 0.70 | TSHR (0.33) | TSHR | |
| SCHEMBL15867788 | 0.69 | CHRM2 (0.41) | CYP2C9CYP2C19 | |
| SCHEMBL16750985 | 0.69 | — | — | |
| SCHEMBL176374 | 0.69 | ALDH1A1 (0.33) | — | |
| SCHEMBL180095 | 0.69 | — | — | |
| SCHEMBL16730136 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0268916-B1 | BIFUNCTIONAL EMULSIFIERS BASED ON PERHYDROPHENOLS AND CARBOXYLIC-ACID ANHYDRIDES | BAYER AG (DE) | 1992-03-25 | — | — | EP | claimed |
| US-4094844-A | Water-borne epoxy resin coating compositions | SHELL OIL COMPANY (US) | 1978-06-13 | — | — | US | disclosed |