Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | MGAM | O43451 | 1/20 | 0.38 |
| ▸ | SI | P14410 | 1/20 | 0.38 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP3 | P08254 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL26529238 | 0.85 | KDM4E (0.40) | ALDH1A1HTTKDM4ETDP1 | |
| SCHEMBL26529438 | 0.85 | SMN1; SMN2 (0.39) | ALDH1A1CYP2C19HTTKDM4EMMP1 | |
| SCHEMBL26529688 | 0.85 | KDM4E (0.37) | ALDH1A1CYP2C19HTTKDM4ETDP1 | |
| SCHEMBL11230401 | 0.85 | CPB2 (0.37) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL26529039 | 0.84 | GAA (0.38) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL26529043 | 0.83 | GAA (0.41) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL21193040 | 0.82 | KMT2A (0.35) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL26529436 | 0.82 | ALDH1A1 (0.42) | ALDH1A1CYP2C19CYP3A4KDM4ELMNA | |
| SCHEMBL26529439 | 0.79 | CA1 (0.34) | GAACYP2C19HTTKDM4EMMP1 | |
| SCHEMBL26529454 | 0.79 | GAA (0.44) | GAAMGAMSIMGAM2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |