Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCL8 | P10145 | 8/20 | 0.71 |
| ▸ | TTR | P02766 | 4/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | TBXA2R | P21731 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 7/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.45 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.45 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.45 |
| ▸ | UGT1A9 | O60656 | 1/20 | 0.45 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.45 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.45 |
| ▸ | ALB | P02768 | 1/20 | 0.45 |
| ▸ | UGT1A6 | P19224 | 1/20 | 0.45 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.45 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3151521 | 0.83 | CXCL8 (1.00) | CXCL8TTRCYP2C9TBXA2RMAPK1 | |
| SCHEMBL3137707 | 0.83 | CXCL8 (1.00) | CXCL8TTRCYP2C9TBXA2RMAPK1 | |
| SCHEMBL12129515 | 0.83 | CXCL8 (1.00) | CXCL8TTRCYP2C9TBXA2RMAPK1 | |
| SCHEMBL11515988 | 0.78 | CXCL8 (0.62) | CXCL8TTRCYP2C9TBXA2RMAPK1 | |
| SCHEMBL8371915 | 0.77 | CXCL8 (0.61) | CXCL8TTRCYP2C9TBXA2RMAPK1 | |
| SCHEMBL2739297 | 0.76 | CXCL8 (0.67) | CXCL8TTRCYP2C9LMNAPTGS2 | |
| SCHEMBL11516024 | 0.75 | CXCL8 (0.58) | CXCL8TTRCYP2C9TBXA2RMAPK1 | |
| SCHEMBL7126780 | 0.75 | CXCL8 (0.82) | CXCL8TTRCYP2C9TBXA2RMAPK1 | |
| SCHEMBL7716835 | 0.74 | CXCL8 (0.73) | CXCL8TTRCYP2C9TBXA2RMAPK1 | |
| SCHEMBL11403823 | 0.74 | CXCL8 (0.73) | CXCL8TTRCYP2C9TBXA2RMAPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109608436-A | Substituted Methylformyl reagent and the method for improving compound physical chemistry and/or pharmacokinetic property using the reagent | 斯法尔制药私人有限公司 | 2019-04-12 | — | — | CN | disclosed |
| CN-103607888-A | Substituted methyl formyl reagents and methods of using the same to improve physicochemical and/or pharmacokinetic properties of compounds | SPHAERA PHARMA PRIVATE LTD | 2014-02-26 | — | — | CN | disclosed |