Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | RHOA | P61586 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27522934 | 0.88 | CYP3A4 (0.79) | CYP3A4ALDH1A1HSD17B10TSHRTDP1 | |
| SCHEMBL64356 | 0.88 | CYP3A4 (0.79) | CYP3A4ALDH1A1HSD17B10TSHRTDP1 | |
| SCHEMBL1131891 | 0.87 | CYP3A4 (0.77) | CYP3A4ALDH1A1HSD17B10TSHRTDP1 | |
| SCHEMBL6261194 | 0.87 | CYP3A4 (0.77) | CYP3A4ALDH1A1HSD17B10TSHRTDP1 | |
| Hydrogen Sulfide SCHEMBL8182655 | 0.87 | CYP3A4 (0.77) | CYP3A4ALDH1A1HSD17B10TSHRTDP1 | |
| SCHEMBL669635 | 0.87 | CYP3A4 (0.77) | CYP3A4ALDH1A1HSD17B10TSHRTDP1 | |
| SCHEMBL1889642 | 0.87 | CYP3A4 (0.77) | CYP3A4ALDH1A1HSD17B10TSHRTDP1 | |
| SCHEMBL18259144 | 0.87 | CYP3A4 (0.77) | CYP3A4ALDH1A1HSD17B10TSHRTDP1 | |
| SCHEMBL1426600 | 0.87 | CYP3A4 (0.77) | CYP3A4ALDH1A1HSD17B10TSHRTDP1 | |
| SCHEMBL7068227 | 0.87 | CYP3A4 (0.77) | CYP3A4ALDH1A1HSD17B10TSHRTDP1 |
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-2531496-A1 | MANUFACTURE OF AN EPOXYETHYL CARBOXYLATE OR GLYCIDYL CARBOXYLATE | Momentive Specialty Chemicals Research Belgium S.A. (BE) | 2012-12-12 | — | — | EP | disclosed |
| WO-2011095294-A1 | MANUFACTURE OF AN EPOXYETHYL CARBOXYLATE OR GLYCIDYL CARBOXYLATE | MOMENTIVE SPECIALTY CHEMICALS RESEARCH S.A. (BE) | 2011-08-11 | — | — | WO | disclosed |