Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 2/20 | 0.55 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.55 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | PARP1 | P09874 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | ESR1 | P03372 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.47 |
| ▸ | CHRNG | P07510 | 1/20 | 0.47 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL3496640 | 0.80 | ALDH1A1 (0.68) | ADRB2ADRB1ADRB3ALDH1A1SMN1; SMN2 | |
| SCHEMBL29534771 | 0.78 | GPR17 (0.65) | ALDH1A1HDAC8HDAC6PARP1SMN1; SMN2 | |
| SCHEMBL28289702 | 0.78 | GPR17 (0.65) | ALDH1A1HDAC8HDAC6PARP1SMN1; SMN2 | |
| SCHEMBL40429 | 0.78 | GPR17 (0.65) | ALDH1A1HDAC8HDAC6PARP1SMN1; SMN2 | |
| SCHEMBL27453283 | 0.78 | PARP1 (0.59) | ALDH1A1HDAC8HDAC6PARP1SMN1; SMN2 | |
| SCHEMBL27417865 | 0.78 | PARP1 (0.55) | ADRB2ADRB1ADRB3HDAC8HDAC6 | |
| SCHEMBL30522592 | 0.77 | ATM (0.67) | HDAC8HDAC6SMN1; SMN2KMT2AATM | |
| SCHEMBL6057062 | 0.77 | RAB9A (0.58) | ADRB2ADRB1ADRB3ALDH1A1HDAC8 | |
| SCHEMBL1754131 | 0.77 | ATM (0.67) | HDAC8HDAC6SMN1; SMN2KMT2AATM | |
| SCHEMBL28404165 | 0.77 | KCNK3 (0.54) | HDAC8HDAC6PARP1SMN1; SMN2KMT2A |
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-108883099-B | Thiazolidinone compounds and use thereof | 石全 | 2021-09-28 | — | — | CN | disclosed |