Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTR | P02766 | 5/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 4/20 | 0.46 |
| ▸ | SLC22A12 | Q96S37 | 6/20 | 0.42 |
| ▸ | EYA3 | Q99504 | 5/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.39 |
| ▸ | ESR1 | P03372 | 3/20 | 0.39 |
| ▸ | PPARG | P37231 | 2/20 | 0.39 |
| ▸ | EYA2 | O00167 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.39 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | ALB | P02768 | 1/20 | 0.39 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL28104534 | 0.77 | SLC22A12 (0.40) | TTRPTPN1SLC22A12EYA3CYP2C9 | |
| SCHEMBL7499188 | 0.76 | PTPN1 (0.74) | TTRPTPN1SLC22A12EYA3CYP2C9 | |
| SCHEMBL28249620 | 0.74 | MAPT (0.45) | TTRPTPN1SLC22A12EYA3ESR1 | |
| SCHEMBL28061856 | 0.71 | GABRA1 (0.45) | ESR1MEN1KMT2AESR2 | |
| SCHEMBL27498982 | 0.69 | ESR1 (0.48) | ESR1MEN1USP2ALDH1A1LMNA | |
| SCHEMBL5483047 | 0.69 | MEN1 (0.41) | TTRPTPN1SLC22A12EYA3CYP2C9 | |
| SCHEMBL28220577 | 0.69 | SLC22A12 (0.56) | TTRPTPN1SLC22A12EYA3CYP2C9 | |
| SCHEMBL28104532 | 0.67 | CYP2C19 (0.62) | TTRPTPN1SLC22A12EYA3CYP2C9 | |
| SCHEMBL23532166 | 0.65 | TTR (0.42) | TTRPTPN1SLC22A12EYA3CYP2C9 | |
| SCHEMBL28282749 | 0.65 | USP7 (0.43) | ESR1ESR2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105218479-B | The new derivatives, preparation method and application of 2- [3- cyano-4-isobutoxy phenyl] -4- methylthiazol-5-formic acid | 湘北威尔曼制药股份有限公司 | 2019-10-25 | — | — | CN | disclosed |
| CN-105272984-B | Pyrazolo [3,4-d] pyrimidin-4-one-derivatives, preparation method and application | 湘北威尔曼制药股份有限公司 | 2019-06-14 | — | — | CN | disclosed |
| CN-106470981-B | The new derivatives, preparation method and application of 2- [3- cyano-4-isobutoxy phenyl] -4- methylthiazol-5-formic acid | 湘北威尔曼制药股份有限公司 | 2019-05-07 | — | — | CN | disclosed |