Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BBOX1 | O75936 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL9567735 | 0.86 | TSHR (0.34) | BBOX1ALDH1A1TSHRACHE | |
| SCHEMBL9567772 | 0.82 | BBOX1 (0.44) | BBOX1ALDH1A1TSHR | |
| Hydrochloric Acid SCHEMBL27981910 | 0.79 | BBOX1 (0.41) | BBOX1ALDH1A1TSHRKMT2AATM | |
| SCHEMBL33742 | 0.79 | — | — | |
| SCHEMBL28071176 | 0.76 | BBOX1 (0.40) | BBOX1ALDH1A1TSHRKMT2AATM | |
| Acrylamide SCHEMBL454374 | 0.76 | ALDH1A1 (0.52) | BBOX1ALDH1A1TSHRKMT2AATM | |
| Hydrochloric Acid SCHEMBL7744315 | 0.76 | BBOX1 (0.43) | BBOX1ALDH1A1TSHRKMT2AATM | |
| Hydrochloric Acid SCHEMBL4587394 | 0.76 | BBOX1 (0.43) | BBOX1ALDH1A1TSHRKMT2AATM | |
| Fluoride Ion SCHEMBL7939983 | 0.76 | BBOX1 (0.43) | BBOX1ALDH1A1TSHRKMT2AATM | |
| Iodide SCHEMBL2173986 | 0.76 | BBOX1 (0.43) | BBOX1ALDH1A1TSHRKMT2AATM |
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-0549006-A2 | Ammonium and phosphonium salts and their use as biocides | FMC CORPORATION (UK) LIMITED (GB) | 1993-06-30 | — | — | EP | disclosed |