Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 5/20 | 0.41 |
| ▸ | CA9 | Q16790 | 5/20 | 0.41 |
| ▸ | CA12 | O43570 | 4/20 | 0.41 |
| ▸ | CA2 | P00918 | 4/20 | 0.41 |
| ▸ | F2 | P00734 | 3/20 | 0.41 |
| ▸ | CA3 | P07451 | 1/20 | 0.41 |
| ▸ | CA6 | P23280 | 1/20 | 0.41 |
| ▸ | CA5A | P35218 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.41 |
| ▸ | PSMD10 | O75832 | 1/20 | 0.40 |
| ▸ | CYP24A1 | Q07973 | 1/20 | 0.40 |
| ▸ | STAT3 | P40763 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.39 |
| ▸ | G6PD | P11413 | 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 | |
|---|---|---|---|---|
| SCHEMBL7535395 | 1.00 | ALDH1A1 (0.42) | ALDH1A1CYP3A4CYP2C9CYP2C19CA1 | |
| SCHEMBL14146858 | 1.00 | ALDH1A1 (0.42) | ALDH1A1CYP3A4CYP2C9CYP2C19CA1 | |
| SCHEMBL20261700 | 1.00 | ALDH1A1 (0.42) | ALDH1A1CYP3A4CYP2C9CYP2C19CA1 | |
| SCHEMBL30573752 | 1.00 | ALDH1A1 (0.42) | ALDH1A1CYP3A4CYP2C9CYP2C19CA1 | |
| SCHEMBL20856190 | 0.98 | ALDH1A1 (0.43) | ALDH1A1CYP3A4CYP2C9CYP2C19CA1 | |
| SCHEMBL1687895 | 0.93 | ALDH1A1 (0.44) | ALDH1A1CYP3A4CYP2C9CYP2C19CA1 | |
| Hydrochloric Acid SCHEMBL28969274 | 0.92 | ALDH1A1 (0.43) | ALDH1A1CYP3A4CYP2C9CYP2C19CA1 | |
| SCHEMBL11050599 | 0.91 | ALDH1A1 (0.48) | ALDH1A1CYP3A4CYP2C9CYP2C19CA1 | |
| SCHEMBL8484861 | 0.91 | ALDH1A1 (0.48) | ALDH1A1CYP3A4CYP2C9CYP2C19CA1 | |
| SCHEMBL8483813 | 0.91 | ALDH1A1 (0.48) | ALDH1A1CYP3A4CYP2C9CYP2C19CA1 |
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-2016001064-A1 | DINUCLEAR METAL(I) COMPLEXES HAVING TETRADENTATE LIGANDS FOR OPTOELECTRONIC APPLICATIONS | CYNORA GMBH (DE) | 2016-01-07 | — | — | WO | disclosed |
| EP-2963044-A1 | Binuclear metal (I) complexes with tetradentate ligands for optoelectronic applications | cynora GmbH (DE) | 2016-01-06 | — | — | EP | disclosed |
| WO-1999011612-A2 | SUBSTITUTED CYCLIC COMPOUNDS AND MIXTURES COMPRISING SAME | ISIS PHARMACEUTICALS, INC. (US) | 1999-03-11 | — | — | WO | disclosed |