Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 1/20 | 0.46 |
| ▸ | HSPA5 | P11021 | 2/20 | 0.45 |
| ▸ | CA2 | P00918 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.44 |
| ▸ | TSHR | P16473 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | BLM | P54132 | 2/20 | 0.42 |
| ▸ | ATM | Q13315 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | GMNN | O75496 | 1/20 | 0.42 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2042110 | 0.92 | DHFR (0.49) | DHFRHSPA5CA2ALDH1A1TSHR | |
| SCHEMBL31245638 | 0.86 | DHFR (0.47) | DHFRHSPA5CA2ALDH1A1TSHR | |
| SCHEMBL292109 | 0.85 | HSPA5 (0.50) | DHFRHSPA5CA2ALDH1A1TSHR | |
| SCHEMBL30464059 | 0.83 | HSPA5 (0.53) | DHFRHSPA5CA2ALDH1A1TSHR | |
| SCHEMBL28384212 | 0.83 | HSPA5 (0.53) | DHFRHSPA5CA2ALDH1A1TSHR | |
| SCHEMBL9817051 | 0.82 | CA2 (0.59) | DHFRHSPA5CA2ALDH1A1TSHR | |
| SCHEMBL28834319 | 0.81 | DHFR (0.41) | DHFRHSPA5CA2ALDH1A1TSHR | |
| SCHEMBL8955910 | 0.80 | HSPA5 (0.51) | DHFRHSPA5CA2ALDH1A1TSHR | |
| SCHEMBL9804719 | 0.79 | ALDH1A1 (0.46) | DHFRHSPA5CA2ALDH1A1TSHR | |
| SCHEMBL7710885 | 0.79 | SCN2A (0.49) | DHFRHSPA5CA2ALDH1A1TSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4173541-A | ANITOXIDANTS | CINCINNATI MILACRON CHEMICALS INC. (US) | 1979-11-06 | — | — | US | disclosed |