Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 5/20 | 0.42 |
| ▸ | CA1 | P00915 | 4/20 | 0.42 |
| ▸ | CA12 | O43570 | 3/20 | 0.42 |
| ▸ | CA7 | P43166 | 3/20 | 0.42 |
| ▸ | CA9 | Q16790 | 3/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.42 |
| ▸ | CA4 | P22748 | 2/20 | 0.42 |
| ▸ | CA6 | P23280 | 2/20 | 0.42 |
| ▸ | CA3 | P07451 | 1/20 | 0.42 |
| ▸ | TYR | P14679 | 1/20 | 0.42 |
| ▸ | DRD1 | P21728 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Paraben SCHEMBL6938135 | 0.83 | CA12 (0.61) | GAAMAPTALDH1A1KDM4ESMN1; SMN2 | |
| Hydroquinone SCHEMBL8945771 | 0.83 | CA2 (0.61) | KMT2AMAPTALDH1A1CA2CA1 | |
| Ethane SCHEMBL4422870 | 0.79 | TSHR (0.50) | KMT2AALDH1A1SMN1; SMN2CA2CA1 | |
| SCHEMBL1878165 | 0.79 | TSHR (0.55) | KMT2AGAAMAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL27893540 | 0.79 | KMT2A (0.60) | KMT2AGAAMAPTRAB9AALDH1A1 | |
| Methylhydroquinone SCHEMBL11341056 | 0.78 | DAO (0.52) | KMT2AGAAMAPTRAB9AALDH1A1 | |
| SCHEMBL14261703 | 0.78 | CYP3A4 (0.58) | KMT2AGAAMAPTRAB9AALDH1A1 | |
| Methane SCHEMBL3628336 | 0.78 | TSHR (0.52) | KMT2AGAAMAPTALDH1A1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL9459198 | 0.78 | TSHR (0.52) | KMT2AGAAMAPTALDH1A1SMN1; SMN2 | |
| Paraben SCHEMBL8851014 | 0.76 | CA12 (0.61) | KMT2AGAAMAPTALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-5569727-A | REACTING A DIEPOXIDE WITH A DIISOCYANATE IN PRESENCE OF POLYMERIZATION CATALYST WHICH IS A COMPLEX OF LEWIS ACID AND LEWIS BASE AND BAKING | EUROPEAISCHE WIRTSCHAFTSGEMEINSCHAFT (LU) | 1996-10-29 | — | — | US | disclosed |