Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.64 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.64 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.64 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.64 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.64 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | INSR | P06213 | 1/20 | 0.47 |
| ▸ | IGF1R | P08069 | 1/20 | 0.47 |
| ▸ | PPARG | P37231 | 1/20 | 0.44 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11605746 | 0.87 | CYP1A2 (0.75) | CYP1A2ALDH1A1CYP3A4HSD17B10CYP2C19 | |
| SCHEMBL4168758 | 0.82 | ALDH1A1 (0.67) | CYP1A2ALDH1A1CYP3A4HSD17B10CYP2C19 | |
| SCHEMBL11446069 | 0.80 | ALDH1A1 (0.64) | CYP1A2ALDH1A1CYP3A4HSD17B10CYP2C19 | |
| SCHEMBL8099994 | 0.80 | ALDH1A1 (0.64) | CYP1A2ALDH1A1CYP3A4HSD17B10CYP2C19 | |
| SCHEMBL11651781 | 0.80 | ALDH1A1 (0.64) | CYP1A2ALDH1A1CYP3A4HSD17B10CYP2C19 | |
| SCHEMBL4341824 | 0.80 | CYP1A2 (0.64) | CYP1A2ALDH1A1CYP3A4HSD17B10CYP2C19 | |
| SCHEMBL8808326 | 0.80 | ALDH1A1 (0.64) | CYP1A2ALDH1A1CYP3A4HSD17B10CYP2C19 | |
| SCHEMBL30447073 | 0.80 | ALDH1A1 (0.64) | CYP1A2ALDH1A1CYP3A4HSD17B10CYP2C19 | |
| Ammonia Solution, Strong SCHEMBL8652657 | 0.78 | ALDH1A1 (0.62) | CYP1A2ALDH1A1CYP3A4HSD17B10CYP2C19 | |
| Hydrochloric Acid SCHEMBL31741338 | 0.78 | ALDH1A1 (0.62) | CYP1A2ALDH1A1CYP3A4HSD17B10CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007022263-A1 | FLUOROGENIC PROBES FOR MEDIUM CHAIN ACYL-COA DEHYDROGENASE ( MCAD ) | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2007-02-22 | — | — | WO | disclosed |