Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 2/20 | 0.47 |
| ▸ | CNR1 | P21554 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MCOLN3 | Q8TDD5 | 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 | |
|---|---|---|---|---|
| SCHEMBL19636452 | 1.00 | CNR2 (0.47) | CNR2CNR1ALDH1A1TSHRHTT | |
| SCHEMBL19636450 | 0.85 | ALDH1A1 (0.46) | CNR2CNR1ALDH1A1TSHRHTT | |
| SCHEMBL19636714 | 0.80 | CNR2 (0.59) | CNR2CNR1ALDH1A1MEN1KMT2A | |
| SCHEMBL19636449 | 0.79 | TDP1 (0.53) | CNR2CNR1ALDH1A1TDP1L3MBTL1 | |
| SCHEMBL7365613 | 0.76 | CNR2 (0.52) | CNR2CNR1MEN1KMT2A | |
| SCHEMBL19636457 | 0.75 | MCHR1 (0.44) | CNR2CNR1ALDH1A1ATMTDP1 | |
| SCHEMBL19636456 | 0.75 | MCHR1 (0.44) | CNR2CNR1ALDH1A1ATMTDP1 | |
| SCHEMBL6121704 | 0.74 | CNR1 (0.73) | CNR2CNR1ALDH1A1TDP1L3MBTL1 | |
| SCHEMBL19636592 | 0.74 | CNR2 (0.55) | CNR2CNR1ALDH1A1TSHRHTT | |
| SCHEMBL28183374 | 0.74 | CNR2 (0.55) | CNR2CNR1ALDH1A1TSHRHTT |
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-107400036-B | A method of synthesis 1,2- dimethylene cyclobutane chipal compounds | 中国科学院福建物质结构研究所 | 2019-09-20 | — | — | CN | disclosed |
| CN-107400036-A | A kind of method of synthesis 1,2- dimethylene cyclobutane chipal compounds | 中国科学院福建物质结构研究所 | 2017-11-28 | — | — | CN | disclosed |