Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.39 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | STS | P08842 | 7/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8554364 | 0.96 | CYP3A4 (0.36) | ESR1TSHRLMNACYP1A2CYP2C19 | |
| SCHEMBL9791903 | 0.94 | ESR1 (0.44) | ESR1TSHRLMNACYP1A2CYP2C19 | |
| SCHEMBL8553995 | 0.91 | MAPT (0.34) | ESR1TSHRLMNACYP1A2CYP2C19 | |
| SCHEMBL9791974 | 0.90 | ALDH1A1 (0.46) | ESR1TSHRLMNACYP1A2CYP2C19 | |
| SCHEMBL9792064 | 0.90 | ALDH1A1 (0.46) | ESR1TSHRLMNACYP1A2CYP2C19 | |
| SCHEMBL9791939 | 0.90 | ALDH1A1 (0.46) | ESR1TSHRLMNACYP1A2CYP2C19 | |
| SCHEMBL8554378 | 0.90 | CYP3A4 (0.40) | TSHRCYP2C19CYP3A4ABCB11ADRA2B | |
| SCHEMBL9792019 | 0.90 | ALDH1A1 (0.42) | ESR1TSHRLMNACYP1A2CYP2C19 | |
| SCHEMBL8557024 | 0.86 | ALK (0.32) | ESR1TSHRALDH1A1CHRM1SLC6A2 | |
| SCHEMBL8555125 | 0.83 | ADRB2 (0.34) | HPGDRECQLRAB9AALDH1A1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0507950-B1 | PROCESS FOR PRODUCING DIACETALS | NEW JAPAN CHEM CO LTD (JP) | 1998-04-08 | — | — | EP | disclosed |
| EP-0507950-A1 | PROCESS FOR PRODUCING DIACETAL | NEW JAPAN CHEMICAL CO.,LTD. (JP) | 1992-10-14 | — | — | EP | disclosed |