Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | MGAM | O43451 | 1/20 | 0.46 |
| ▸ | SI | P14410 | 1/20 | 0.46 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.36 |
| ▸ | MIF | P14174 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | PPM1B | O75688 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20161669 | 0.85 | GAA (0.38) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL1252907 | 0.83 | PRKD3 (0.33) | HSD17B10 | |
| SCHEMBL14477587 | 0.81 | CYP3A4 (0.34) | HSD17B10 | |
| SCHEMBL1199242 | 0.81 | MGAM (0.44) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL12899473 | 0.80 | PPM1B (0.39) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL12899471 | 0.80 | PPM1B (0.39) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL9260657 | 0.77 | — | — | |
| SCHEMBL903262 | 0.77 | MGAM (0.44) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL8430342 | 0.76 | PPM1B (0.30) | PPM1BPTPN1PPP1CC | |
| SCHEMBL1372863 | 0.75 | TLR4 (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009030928-A2 | A PROCESS FOR MAKING AND USING HOF.RCN | THE SECRETARY OF STATE FOR DEFENCE (GB) | 2009-03-12 | — | — | WO | disclosed |
| EP-0394844-B1 | PROCESS FOR THE PREPARATION OF 4-KETOCARBOXYLIC ACIDS AND THEIR ESTERS | BASF Aktiengesellschaft (DE) | 1993-08-04 | — | — | EP | disclosed |
| EP-0394844-A1 | Process for the preparation of 4-ketocarboxylic acids and their esters | BASF Aktiengesellschaft (DE) | 1990-10-31 | — | — | EP | disclosed |