Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 1/20 | 0.56 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | P2RY6 | Q15077 | 2/20 | 0.46 |
| ▸ | P2RY14 | Q15391 | 2/20 | 0.46 |
| ▸ | NT5E | P21589 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 5/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | CCNA2 | P20248 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13881286 | 1.00 | ABL1 (0.56) | ABL1RIN1POLBP2RY6P2RY14 | |
| SCHEMBL3766629 | 0.81 | ABL1 (0.54) | ABL1RIN1POLBP2RY6P2RY14 | |
| SCHEMBL3766631 | 0.81 | ABL1 (0.54) | ABL1RIN1POLBP2RY6P2RY14 | |
| SCHEMBL13881215 | 0.79 | ABL1 (0.60) | ABL1RIN1POLBP2RY6P2RY14 | |
| SCHEMBL12995069 | 0.79 | ABL1 (0.60) | ABL1RIN1POLBP2RY6P2RY14 | |
| SCHEMBL12995205 | 0.79 | ABL1 (0.60) | ABL1RIN1POLBP2RY6P2RY14 | |
| SCHEMBL3657498 | 0.79 | ABL1 (0.57) | ABL1RIN1POLBP2RY6P2RY14 | |
| SCHEMBL3657470 | 0.77 | ABL1 (0.52) | ABL1RIN1POLBP2RY6P2RY14 | |
| SCHEMBL3658551 | 0.77 | ABL1 (0.52) | ABL1RIN1POLBP2RY6P2RY14 | |
| SCHEMBL3657471 | 0.77 | ABL1 (0.52) | ABL1RIN1POLBP2RY6P2RY14 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2190839-B1 | A PROCESS FOR CHIRAL RESOLUTION OF 2-SUBSTITUTED 4-SUBSTITUTED 1,3-OXATHIOLANES | AVEXA LTD (AU) | 2015-04-15 | — | — | EP | disclosed |