Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 2/20 | 0.52 |
| ▸ | DNM1 | Q05193 | 8/20 | 0.43 |
| ▸ | CASP2 | P42575 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | F13A1 | P00488 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | CA4 | P22748 | 2/20 | 0.43 |
| ▸ | CA6 | P23280 | 2/20 | 0.43 |
| ▸ | CA5A | P35218 | 2/20 | 0.43 |
| ▸ | THPO | P40225 | 2/20 | 0.43 |
| ▸ | CA7 | P43166 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.43 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL27121 | 0.91 | — | — | |
| SCHEMBL12501988 | 0.91 | CA12 (0.50) | EPHX1DNM1CASP2MEN1KMT2A | |
| SCHEMBL4766952 | 0.88 | — | — | |
| SCHEMBL7886703 | 0.88 | — | — | |
| Ethylenediamine SCHEMBL20582708 | 0.88 | CA12 (0.47) | EPHX1DNM1CASP2MEN1KMT2A | |
| Ammonia Solution, Strong SCHEMBL16346386 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL4717644 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL3387948 | 0.88 | — | — | |
| Propanol SCHEMBL28927312 | 0.87 | EPHX1 (0.46) | EPHX1DNM1CASP2MEN1KMT2A | |
| Alcohol SCHEMBL10617366 | 0.86 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-103635551-B | Waterborne polyurethane coating compositions | 拜尔材料科学有限公司 | 2017-02-22 | — | — | CN | disclosed |