Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.67 |
| ▸ | PKM | P14618 | 3/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.67 |
| ▸ | MEN1 | O00255 | 1/20 | 0.67 |
| ▸ | GAA | P10253 | 1/20 | 0.66 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.66 |
| ▸ | LMNA | P02545 | 1/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.66 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.62 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.54 |
| ▸ | MMP1 | P03956 | 2/20 | 0.53 |
| ▸ | MMP2 | P08253 | 2/20 | 0.53 |
| ▸ | MMP9 | P14780 | 2/20 | 0.53 |
| ▸ | MMP13 | P45452 | 2/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.53 |
| ▸ | MMP8 | P22894 | 1/20 | 0.53 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL12656334 | 0.91 | ALDH1A1 (0.75) | ALDH1A1PKMKMT2AMEN1GAA | |
| SCHEMBL5499591 | 0.91 | ALDH1A1 (0.59) | ALDH1A1PKMKMT2AMEN1GAA | |
| SCHEMBL23683085 | 0.91 | GAA (0.61) | ALDH1A1PKMKMT2AMEN1GAA | |
| SCHEMBL24762016 | 0.91 | GAA (0.57) | ALDH1A1PKMKMT2AMEN1GAA | |
| SCHEMBL2013273 | 0.91 | ALDH1A1 (0.59) | ALDH1A1PKMKMT2AMEN1GAA | |
| SCHEMBL23683108 | 0.91 | GAA (0.57) | ALDH1A1PKMKMT2AMEN1GAA | |
| SCHEMBL10078758 | 0.91 | ALDH1A1 (0.75) | ALDH1A1PKMKMT2AMEN1GAA | |
| SCHEMBL9577239 | 0.90 | SIGMAR1 (0.68) | ALDH1A1PKMKMT2AMEN1GAA | |
| SCHEMBL21820680 | 0.89 | ALDH1A1 (0.72) | ALDH1A1PKMKMT2AMEN1GAA | |
| SCHEMBL2007611 | 0.89 | GAA (0.59) | ALDH1A1PKMKMT2AMEN1GAA |
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-4981890-A | POLYHALOAROMATIC AND AROMATIC BIS-SULFONAMIDE | ETHYL CORPORATION (US) | 1991-01-01 | — | — | US | disclosed |
| US-4957958-A | IMPROVED MELT FLOW | ETHYL CORPORATION (US) | 1990-09-18 | — | — | US | disclosed |