Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | ANPEP | P15144 | 1/20 | 0.38 |
| ▸ | ADH1B | P00325 | 1/20 | 0.38 |
| ▸ | ADH1C | P00326 | 1/20 | 0.38 |
| ▸ | ADH1A | P07327 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | SCN1A | P35498 | 1/20 | 0.36 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.36 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20580387 | 0.78 | SMN1; SMN2 (0.49) | TSHRANPEPADH1BADH1CADH1A | |
| SCHEMBL21359152 | 0.75 | SMN1; SMN2 (0.42) | TSHRALDH1A1CYP2D6CYP2C19SMN1; SMN2 | |
| SCHEMBL23102141 | 0.75 | SMN1; SMN2 (0.42) | TSHRALDH1A1CYP2D6CYP2C19SMN1; SMN2 | |
| SCHEMBL7218084 | 0.73 | TSHR (0.46) | TSHRALDH1A1CYP2C19SMN1; SMN2KDM4E | |
| SCHEMBL6744316 | 0.73 | TSHR (0.46) | TSHRALDH1A1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL8954837 | 0.73 | TSHR (0.46) | TSHRALDH1A1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL1171356 | 0.73 | TSHR (0.46) | TSHRALDH1A1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL6744319 | 0.73 | TSHR (0.46) | TSHRALDH1A1SMN1; SMN2KDM4EMAPT | |
| Acetone SCHEMBL2672218 | 0.71 | CYP2D6 (0.50) | ANPEPADH1BADH1CADH1AALDH1A1 | |
| SCHEMBL16466729 | 0.71 | TSHR (0.45) | TSHRALDH1A1SMN1; SMN2KDM4EMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-20230321591-A1 | Beta-Amino Carboxylate (BAC) Solvents for Enhanced CO2 Separations | BATTELLE MEMORIAL INSTITUTE | 2023-10-12 | — | — | US | disclosed |
| US-20230321591-A1 | Beta-Amino Carboxylate (BAC) Solvents for Enhanced CO2 Separations | BATTELLE MEMORIAL INSTITUTE | 2023-10-12 | — | — | US | disclosed |
| WO-2023192410-A1 | BETA-AMINO CARBOXYLATE (BAC) SOLVENTS FOR ENHANCED CO2 SEPARATIONS | BATTELLE MEMORIAL INSTITUTE (US) | 2023-10-05 | — | — | WO | disclosed |