Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.31 |
| ▸ | FABP4 | P15090 | 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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL17964267 | 0.86 | PTGS1 (0.38) | PTGS1ALDH1A1KDM4EMAPTCA1 | |
| Acetone SCHEMBL20186006 | 0.84 | CA1 (0.36) | PTGS1ALDH1A1CA1CA2MCL1 | |
| SCHEMBL7196734 | 0.81 | ALDH1A1 (0.35) | PTGS1ALDH1A1MAPTCA1CA2 | |
| Methyl Alcohol SCHEMBL27301818 | 0.81 | CA1 (0.41) | PTGS1ALDH1A1KDM4EMAPTHPGD | |
| Ammonia Solution, Strong SCHEMBL5027721 | 0.78 | — | — | |
| Phosphine SCHEMBL7200715 | 0.78 | — | — | |
| SCHEMBL6139750 | 0.77 | CA1 (0.38) | ALDH1A1CA1CA2TDP1 | |
| SCHEMBL27489720 | 0.75 | ALDH1A1 (0.39) | ALDH1A1KDM4EMAPTHPGDHTT | |
| Acetaldehyde SCHEMBL6632642 | 0.75 | TSHR (0.31) | ALDH1A1CA1CA2TDP1 | |
| SCHEMBL6853752 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012076699-A1 | BIOCIDE MICROCAPSULE FORMULATIONS CONTAINING STABILISED IODINE-CONTAINING COMPOUNDS | LANXESS DEUTSCHLAND GMBH (DE) | 2012-06-14 | — | — | WO | claimed |