Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | NQO1 | P15559 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 4/20 | 0.34 |
| ▸ | RAB9A | P51151 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | LTA4H | P09960 | 3/20 | 0.33 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.33 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2579282 | 0.82 | KCNA3 (0.54) | SMN1; SMN2ALDH1A1LTA4HKCNA3 | |
| SCHEMBL21874942 | 0.81 | LTA4H (0.33) | KDM4ESMN1; SMN2ALDH1A1CYP2D6NPC1 | |
| SCHEMBL16248363 | 0.81 | ALDH1A1 (0.41) | KDM4ESMN1; SMN2ALDH1A1CYP2D6CYP3A4 | |
| SCHEMBL16248366 | 0.79 | ALDH1A1 (0.40) | KDM4ESMN1; SMN2ALDH1A1CYP2D6CYP3A4 | |
| SCHEMBL10592137 | 0.79 | TDP1 (0.55) | KDM4ESMN1; SMN2ALDH1A1CYP2D6CYP3A4 | |
| SCHEMBL20226245 | 0.79 | CYP2D6 (0.59) | KDM4ESMN1; SMN2CYP2D6CYP3A4NPC1 | |
| SCHEMBL16248365 | 0.79 | ALDH1A1 (0.40) | KDM4ESMN1; SMN2ALDH1A1CYP2D6CYP3A4 | |
| SCHEMBL17514674 | 0.78 | KCNA3 (0.37) | KDM4ESMN1; SMN2ALDH1A1CYP2D6CYP3A4 | |
| SCHEMBL30537732 | 0.77 | MAPK1 (0.48) | KDM4EALDH1A1CYP2D6CYP3A4MAPT | |
| SCHEMBL11405912 | 0.77 | MEN1 (0.48) | KDM4ESMN1; SMN2ALDH1A1NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-1050033-A | The substrate of filmated surface modification | MERCK PATENT GMBH (DE) | 1991-03-20 | — | — | CN | disclosed |