Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 7/20 | 0.36 |
| ▸ | CES2 | O00748 | 3/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.35 |
| ▸ | FFAR3 | O14843 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 8/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | CTSD | P07339 | 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 | |
|---|---|---|---|---|
| SCHEMBL1925937 | 0.77 | ALDH1A1 (0.32) | TSHRALDH1A1 | |
| SCHEMBL7953031 | 0.73 | CES1 (0.41) | CES1CES2HDAC3HDAC1HDAC2 | |
| SCHEMBL3787603 | 0.73 | FAAH (0.59) | CES1CES2TSHRALDH1A1FAAH | |
| SCHEMBL3777162 | 0.73 | FAAH (0.59) | CES1CES2TSHRALDH1A1FAAH | |
| SCHEMBL3778978 | 0.73 | FAAH (0.59) | CES1CES2TSHRALDH1A1FAAH | |
| SCHEMBL9435633 | 0.73 | FAAH (0.59) | CES1CES2TSHRALDH1A1FAAH | |
| SCHEMBL3777756 | 0.73 | FAAH (0.59) | CES1CES2TSHRALDH1A1FAAH | |
| SCHEMBL2860845 | 0.71 | CES1 (0.39) | CES1CES2HDAC3HDAC1HDAC2 | |
| SCHEMBL28143323 | 0.71 | CES1 (0.39) | CES1CES2HDAC3HDAC1HDAC2 | |
| SCHEMBL5322489 | 0.71 | CES2 (0.35) | CES1CES2HDAC3HDAC1HDAC2 |
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-105693595-B | The synthetic method of one kind (R) -3- amino -1,2,3,4- tetrahydro carbazoles | 上海亚兴生物医药科技有限公司 | 2018-09-28 | — | — | CN | disclosed |
| CN-107827721-A | A kind of method for synthesizing 4 fluorine cyclohexanone | 上海恩氟佳科技有限公司 | 2018-03-23 | — | — | CN | disclosed |