Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.41 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.41 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7471503 | 0.81 | ALDH1A1 (0.51) | ALDH1A1TSHRHPGDSMN1; SMN2MEN1 | |
| SCHEMBL5333075 | 0.81 | CYP1A2 (0.66) | CYP1A2ALOX5TDP1ALDH1A1GPR35 | |
| SCHEMBL11429326 | 0.76 | CYP1A2 (0.57) | CYP1A2ALOX5TDP1ALDH1A1GPR35 | |
| SCHEMBL7471515 | 0.76 | POLB (0.50) | CYP1A2ALDH1A1TSHRHPGDSMN1; SMN2 | |
| SCHEMBL10536120 | 0.76 | TSHR (0.54) | CYP1A2TDP1ALDH1A1TSHRMAPT | |
| SCHEMBL5248985 | 0.75 | CYP1A2 (0.59) | CYP1A2ALOX5TDP1ALDH1A1GPR35 | |
| SCHEMBL27961047 | 0.75 | CYP1A2 (0.68) | CYP1A2ALOX5TDP1ALDH1A1GPR35 | |
| SCHEMBL11775774 | 0.74 | CYP1A2 (0.58) | CYP1A2ALOX5TDP1ALDH1A1GPR35 | |
| SCHEMBL11778027 | 0.74 | CYP1A2 (0.58) | CYP1A2TDP1ALDH1A1GPR35MAPK1 | |
| SCHEMBL9173837 | 0.73 | CYP1A2 (0.60) | CYP1A2ALOX5TDP1ALDH1A1GPR35 |
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-105669548-B | A kind of method of manganese compound catalysis oxidation pyridine compounds and their synthesis ketone | 中国科学院大连化学物理研究所 | 2018-04-03 | — | — | CN | disclosed |
| CN-107652664-A | A kind of photosensitive colour-changing TPU film for adhering film to glass and preparation method thereof | 东莞市雄林新材料科技股份有限公司 | 2018-02-02 | — | — | CN | disclosed |