Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.35 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.35 |
| ▸ | TAS1R2 | Q8TE23 | 3/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | MLYCD | O95822 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL25135055 | 0.86 | TAS1R3 (0.46) | CA2TAS1R3TAS1R1TAS1R2ESR1 | |
| SCHEMBL25134488 | 0.86 | TAS1R3 (0.46) | CA2TAS1R3TAS1R1TAS1R2ESR1 | |
| SCHEMBL25135063 | 0.86 | TAS1R3 (0.46) | CA2TAS1R3TAS1R1TAS1R2ESR1 | |
| SCHEMBL4339773 | 0.81 | CYP3A4 (0.34) | TAS1R3TAS1R1TAS1R2POLBSMN1; SMN2 | |
| SCHEMBL8540474 | 0.77 | L3MBTL1 (0.33) | TAS1R3TAS1R1TAS1R2CYP3A4CYP2C9 | |
| SCHEMBL8540473 | 0.77 | L3MBTL1 (0.33) | TAS1R3TAS1R1TAS1R2CYP3A4CYP2C9 | |
| SCHEMBL4337694 | 0.75 | POLB (0.34) | TAS1R3TAS1R1TAS1R2ALDH1A1POLB | |
| SCHEMBL958597 | 0.75 | CA2 (0.46) | CA2ESR1KCNH2ALDH1A1POLB | |
| SCHEMBL6429491 | 0.74 | CA2 (0.46) | CA2ESR1KCNH2ALDH1A1POLB | |
| SCHEMBL18730508 | 0.73 | ALDH1A1 (0.36) | TAS1R3TAS1R1TAS1R2ALDH1A1POLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023109926-A1 | SPIROOXINDOLE COMPOUND AND USE THEREOF IN PREPARATION OF PROTEASE INHIBITOR AS ANTIVIRAL DRUG | 南京药石科技股份有限公司 | 2023-06-22 | — | — | WO | disclosed |