Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10939422 | 0.89 | — | — | |
| SCHEMBL11854273 | 0.78 | TSHR (0.44) | TSHRCYP1A2 | |
| SCHEMBL10942922 | 0.77 | TRPA1 (0.45) | — | |
| SCHEMBL10918052 | 0.76 | KIF11 (0.31) | TSHR | |
| SCHEMBL11761677 | 0.75 | CYP3A4 (0.38) | TSHRCYP1A2 | |
| SCHEMBL430195 | 0.74 | ESR1 (0.41) | TSHR | |
| SCHEMBL28244087 | 0.74 | ESR1 (0.41) | TSHR | |
| SCHEMBL10939412 | 0.74 | CYP3A4 (0.34) | — | |
| SCHEMBL9555423 | 0.71 | TSHR (0.36) | TSHR | |
| SCHEMBL6430083 | 0.71 | TSHR (0.36) | TSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0092454-B1 | HALOGENATED AROMATIC ISOCYANATES OR THEIR MIXTURES HAVING A DIPHENYL-METHANE STRUCTURE | ELF ATOCHEM S.A. (FR) | 1985-11-27 | — | — | EP | claimed |