Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | CHRM2 | P08172 | 6/20 | 0.53 |
| ▸ | CHRM1 | P11229 | 6/20 | 0.53 |
| ▸ | CHRM3 | P20309 | 5/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | HTR1A | P08908 | 1/20 | 0.53 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.53 |
| ▸ | DRD1 | P21728 | 1/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.53 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.53 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.53 |
| ▸ | DRD3 | P35462 | 1/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL169629 | 0.86 | CHRM1 (0.56) | LMNACYP1A2CYP2D6CYP3A4ALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL28164353 | 0.85 | CHRM1 (0.54) | LMNACYP1A2CYP2D6CYP3A4ALDH1A1 | |
| SCHEMBL10546414 | 0.82 | CASP1 (0.55) | LMNACYP1A2CYP2D6ALDH1A1SMN1; SMN2 | |
| SCHEMBL27075143 | 0.79 | IDO1 (0.40) | LMNACYP1A2CYP2D6CYP3A4ALDH1A1 | |
| Adiphenine SCHEMBL27972992 | 0.79 | LMNA (0.94) | LMNACYP1A2CYP2D6CYP3A4ALDH1A1 | |
| Adiphenine SCHEMBL248213 | 0.79 | LMNA (1.00) | LMNACYP1A2CYP2D6CYP3A4ALDH1A1 | |
| SCHEMBL8070811 | 0.78 | CHRM1 (0.45) | LMNACYP1A2CYP2D6CYP3A4ALDH1A1 | |
| Adiphenine SCHEMBL33478 | 0.77 | CYP3A4 (1.00) | LMNACYP1A2CYP2D6CYP3A4ALDH1A1 | |
| SCHEMBL28779027 | 0.77 | CYP2D6 (0.42) | LMNACYP1A2CYP2D6CYP3A4ALDH1A1 | |
| SCHEMBL5930869 | 0.77 | LMNA (0.58) | LMNACYP1A2CYP2D6CYP3A4ALDH1A1 |
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-112538144-A | Alkali-resistant sodium diisooctyl succinate sulfonate and preparation method thereof | 广东灵捷制造化工有限公司 | 2021-03-23 | — | — | CN | claimed |
| CN-112538144-A | Alkali-resistant sodium diisooctyl succinate sulfonate and preparation method thereof | 广东灵捷制造化工有限公司 | 2021-03-23 | — | — | CN | disclosed |