Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 3/20 | 0.45 |
| ▸ | GFER | P55789 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | TERT | O14746 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6829157 | 0.82 | TERT (0.44) | HTTPOLBGFERKDM4ECYP1A2 | |
| SCHEMBL6923697 | 0.81 | TERT (0.46) | POLBKDM4EMEN1KMT2AALDH1A1 | |
| SCHEMBL4942973 | 0.76 | SLC9A1 (0.57) | HTTPOLBGFERKDM4ECYP1A2 | |
| SCHEMBL69791 | 0.76 | HTT (0.69) | HTTPOLBKDM4ECYP1A2CYP2C19 | |
| Ethylene SCHEMBL22615238 | 0.72 | HTT (0.64) | HTTPOLBKDM4ECYP1A2CYP2C19 | |
| SCHEMBL29334902 | 0.71 | HTT (0.58) | HTTPOLBGFERKDM4ECYP1A2 | |
| SCHEMBL4675517 | 0.71 | HTT (0.58) | HTTPOLBGFERKDM4ECYP1A2 | |
| Propane SCHEMBL28412029 | 0.70 | HTT (0.68) | HTTPOLBKDM4ECYP1A2CYP2C19 | |
| SCHEMBL21981938 | 0.70 | HTT (0.67) | HTTPOLBKDM4ECYP1A2CYP2C19 | |
| SCHEMBL1660549 | 0.69 | HTT (0.60) | HTTPOLBKDM4ECYP1A2CYP2C19 |
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-2004037808-A1 | 2 - SUBSTITUTED HETEROCYCLIC COMPOUNDS AND ANTITUMOR COMPOSITION COMPRISING THE SAME | CHONG KUN DANG PHARMACEUTICAL CORP. (KR) | 2004-05-06 | — | — | WO | disclosed |