Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.69 |
| ▸ | LCK | P06239 | 1/20 | 0.69 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.67 |
| ▸ | HPGD | P15428 | 5/20 | 0.67 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.60 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.60 |
| ▸ | LMNA | P02545 | 1/20 | 0.60 |
| ▸ | CA12 | O43570 | 1/20 | 0.58 |
| ▸ | CA1 | P00915 | 1/20 | 0.58 |
| ▸ | CA2 | P00918 | 1/20 | 0.58 |
| ▸ | CA3 | P07451 | 1/20 | 0.58 |
| ▸ | CA4 | P22748 | 1/20 | 0.58 |
| ▸ | CA5A | P35218 | 1/20 | 0.58 |
| ▸ | CA7 | P43166 | 1/20 | 0.58 |
| ▸ | CA9 | Q16790 | 1/20 | 0.58 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.58 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.58 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL28384155 | 0.91 | KDM4E (0.64) | KDM4ELCKCYP2D6ALDH1A1HPGD | |
| SCHEMBL3194989 | 0.88 | KDM4E (0.72) | KDM4ELCKCYP2D6ALDH1A1HPGD | |
| SCHEMBL15984893 | 0.87 | KDM4E (0.71) | KDM4ELCKCYP2D6ALDH1A1HPGD | |
| SCHEMBL29975674 | 0.86 | CYP2D6 (0.68) | KDM4ELCKCYP2D6ALDH1A1HPGD | |
| SCHEMBL9797535 | 0.86 | CYP2D6 (0.68) | KDM4ELCKCYP2D6ALDH1A1HPGD | |
| SCHEMBL6031499 | 0.85 | CYP2D6 (0.76) | KDM4ELCKCYP2D6ALDH1A1HPGD | |
| SCHEMBL14473750 | 0.85 | KDM4E (0.76) | KDM4ELCKCYP2D6ALDH1A1HPGD | |
| SCHEMBL9387319 | 0.84 | CYP2D6 (0.74) | KDM4ELCKCYP2D6ALDH1A1HPGD | |
| SCHEMBL22632087 | 0.83 | CYP2D6 (0.76) | KDM4ELCKCYP2D6ALDH1A1HPGD | |
| SCHEMBL4206240 | 0.83 | ALDH1A1 (0.58) | KDM4ECYP2D6ALDH1A1HPGDHSD17B10 |
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-1534839-A1 | CAGED TETRACYCLINE (DERIVATIVES), THEIR GENERATION, AND THEIR USE FOR PHOTOACTIVATED GENE EXPRESSION | Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2005-06-01 | — | — | EP | disclosed |
| WO-2004018686-A1 | CAGED TETRACYCLINE (DERIVATIVES), THEIR GENERATION, AND THEIR USE FOR PHOTOACTIVATED GENE EXPRESSION | MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2004-03-04 | — | — | WO | disclosed |