Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | ACLY | P53396 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5324930 | 0.87 | ACLY (0.49) | HTTMEN1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL28606837 | 0.87 | HTT (0.62) | HTTMEN1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL13226834 | 0.83 | MAPT (0.46) | HTTMEN1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8058000 | 0.83 | HTT (0.58) | HTTMEN1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL7923403 | 0.79 | HTT (0.53) | HTTMEN1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL13208211 | 0.79 | MAOB (0.42) | HTTMEN1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL21020699 | 0.79 | MAPT (0.42) | HTTMEN1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL10054997 | 0.77 | HTT (0.56) | HTTMEN1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL11831264 | 0.77 | HTT (0.63) | HTTCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL1196472 | 0.77 | MAOB (0.56) | MAPTHIF1AKDM4ELMNAMAPK1 |
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-2009042092-A1 | 2-ARYL OR HETEROARYL INDOLE DERIVATIVES | MERCK & CO., INC. (US) | 2009-04-02 | — | — | WO | disclosed |