Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.49 |
| ▸ | ERN1 | O75460 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.38 |
| ▸ | ABAT | P80404 | 1/20 | 0.38 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.38 |
| ▸ | G6PD | P11413 | 1/20 | 0.38 |
| ▸ | CRHBP | P24387 | 1/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30364804 | 0.87 | GPR35 (0.62) | GPR35ERN1TDP1ALDH1A1TSHR | |
| SCHEMBL1273865 | 0.87 | GPR35 (0.62) | GPR35ERN1TDP1ALDH1A1TSHR | |
| SCHEMBL29000828 | 0.85 | GPR35 (0.60) | GPR35ERN1TDP1ALDH1A1TSHR | |
| Nitrophenolate SCHEMBL2343871 | 0.73 | GPR35 (0.50) | GPR35ERN1TDP1ALDH1A1TSHR | |
| SCHEMBL1460867 | 0.73 | TDP1 (0.61) | GPR35TDP1ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL1982756 | 0.72 | HPGD (0.47) | GPR35ERN1TDP1ALDH1A1TSHR | |
| Nitrophenolate SCHEMBL28749822 | 0.72 | GPR35 (0.57) | GPR35TDP1ALDH1A1TSHRMAPT | |
| Formic Acid Methyl Ester SCHEMBL28323293 | 0.72 | ALDH1A1 (0.48) | TDP1ALDH1A1MAPTPOLBSMN1; SMN2 | |
| SCHEMBL688711 | 0.71 | GPR35 (0.56) | GPR35ERN1TDP1ALDH1A1TSHR | |
| SCHEMBL2496089 | 0.71 | TDP1 (0.67) | TDP1ALDH1A1TSHRMAPTSMN1; SMN2 |
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-110016021-A | A kind of immunomodulator | 成都先导药物开发股份有限公司 | 2019-07-16 | — | — | CN | disclosed |