Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | CA1 | P00915 | 5/20 | 0.39 |
| ▸ | CA2 | P00918 | 5/20 | 0.39 |
| ▸ | CA12 | O43570 | 4/20 | 0.39 |
| ▸ | CA7 | P43166 | 4/20 | 0.39 |
| ▸ | CA9 | Q16790 | 4/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA6 | P23280 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.38 |
| ▸ | SELL | P14151 | 1/20 | 0.37 |
| ▸ | SELP | P16109 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | THRB | P10828 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL23853877 | 0.85 | CA12 (0.52) | KDM4EKMT2ACA1CA2CA12 | |
| SCHEMBL1171212 | 0.85 | KDM4E (0.47) | KDM4EKMT2ACA1CA2CA12 | |
| SCHEMBL593852 | 0.85 | KMT2A (0.39) | KDM4EKMT2ACA1CA2CA12 | |
| SCHEMBL7067360 | 0.81 | SELL (0.50) | KDM4EKMT2ACA1CA2CA12 | |
| SCHEMBL28194744 | 0.81 | TSHR (0.43) | KDM4EKMT2ACA1CA2CA12 | |
| SCHEMBL28194746 | 0.81 | CA12 (0.46) | KDM4EKMT2ACA1CA2CA12 | |
| Nitrous Acid SCHEMBL28558486 | 0.77 | KDM4E (0.41) | KDM4EKMT2AALDH1A1SMN1; SMN2NAPRT | |
| SCHEMBL1245001 | 0.76 | KDM4E (0.53) | KDM4EKMT2AALDH1A1HPGDNAPRT | |
| SCHEMBL21749937 | 0.76 | HCAR2 (0.41) | KDM4EKMT2ACA1CA2CA12 | |
| SCHEMBL28378544 | 0.76 | KDM4E (0.48) | KDM4EKMT2AALDH1A1HPGDSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109836373-A | A kind of environmentally friendly method prepared and circulation of tail gas utilizes of vitamin B6 | 新发药业有限公司 | 2019-06-04 | — | — | CN | disclosed |
| CN-109836374-A | A kind of vitamin B6Environment-friendly preparation method | 新发药业有限公司 | 2019-06-04 | — | — | CN | disclosed |