Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.86 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.32 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.32 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 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 | |
|---|---|---|---|---|
| SCHEMBL1330919 | 0.93 | — | — | |
| SCHEMBL23785 | 0.93 | — | — | |
| SCHEMBL6368222 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL8669936 | 0.90 | — | — | |
| Nitrogen SCHEMBL15994321 | 0.88 | ALDH1A1 (0.90) | ALDH1A1KMT2AESR1CDK1CCNB1 | |
| Methyl Alcohol SCHEMBL28312507 | 0.88 | ALDH1A1 (0.90) | ALDH1A1KMT2AESR1CDK1CCNB1 | |
| SCHEMBL3915708 | 0.86 | ALDH1A1 (0.78) | ALDH1A1KMT2AESR1CDK1CCNB1 | |
| Nitrous Acid SCHEMBL14660251 | 0.86 | ALDH1A1 (0.86) | ALDH1A1KMT2AESR1CDK1CCNB1 | |
| SCHEMBL4778646 | 0.84 | ALDH1A1 (0.82) | ALDH1A1KMT2AESR1CDK1CCNB1 | |
| SCHEMBL28187381 | 0.84 | ALDH1A1 (0.82) | ALDH1A1KMT2AESR1CDK1CCNB1 |
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-103249720-A | Oxime compounds as HDL-holesterol raising agents | HOFFMANN LA ROCHE | 2013-08-14 | — | — | CN | disclosed |