Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.37 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.37 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.37 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.37 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.37 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28114930 | 0.87 | KMT2A (0.44) | KMT2ACASP1ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL4332774 | 0.78 | ALDH1A1 (0.40) | KMT2AALDH1A1CYP1A2TSHRPOLB | |
| SCHEMBL6205026 | 0.78 | TDP1 (0.44) | KMT2AALDH1A1CYP1A2POLBLMNA | |
| SCHEMBL7763285 | 0.77 | ALDH1A1 (0.40) | KMT2AALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL28031055 | 0.77 | ALDH1A1 (0.35) | KMT2AALDH1A1POLBLMNATDP1 | |
| SCHEMBL23214259 | 0.77 | TSHR (0.48) | KMT2AALDH1A1CYP1A2TSHRTDP1 | |
| SCHEMBL29796101 | 0.77 | TSHR (0.48) | KMT2AALDH1A1CYP1A2TSHRTDP1 | |
| SCHEMBL28942807 | 0.77 | POLB (0.44) | CASP1ALDH1A1POLBTDP1KDM4E | |
| SCHEMBL11317490 | 0.76 | LMNA (0.44) | KMT2AALDH1A1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL8094211 | 0.75 | ALDH1A1 (0.38) | KMT2AALDH1A1TSHRPOLBLMNA |
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-106187803-A | The synthetic method of the amides compound that a kind of phosphorus oxychloride promotes | 中国人民解放军63975部队 | 2016-12-07 | — | — | CN | disclosed |