Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.42 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | CASR | P41180 | 5/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.33 |
| ▸ | CRHBP | P24387 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4342004 | 0.80 | KMT2A (0.54) | TSHRNPC1LMNAMAPTMEN1 | |
| SCHEMBL4347844 | 0.80 | KMT2A (0.43) | GABRA1GABRB1HSPA5NPC1CASR | |
| SCHEMBL4351678 | 0.79 | DDX3X (0.49) | NPC1MAPTHPGDMEN1KMT2A | |
| SCHEMBL4342233 | 0.79 | GRIK1 (0.51) | NPC1LMNAMAPTMEN1KMT2A | |
| SCHEMBL4355998 | 0.77 | GABRA1 (0.41) | GABRA1GABRB1LMNAMAPTHPGD | |
| SCHEMBL4352244 | 0.76 | GABRA1 (0.35) | GABRA1GABRB1HSPA5CASRMAPT | |
| SCHEMBL4347852 | 0.76 | GRIK1 (0.55) | LMNAMAPTHPGDKMT2AKDM4E | |
| SCHEMBL27782802 | 0.76 | MAPT (0.46) | CASRMAPTHPGDALDH1A1 | |
| SCHEMBL4351118 | 0.76 | CXCL8 (0.44) | LMNAMAPTMEN1KMT2ANLRP3 | |
| SCHEMBL11340181 | 0.75 | GABRA1 (0.70) | GABRA1GABRB1TSHRLMNAMAPT |
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-100546977-C | Suppress the new compound and the application thereof of rotamase | JERINI AG (DE) | 2009-10-07 | — | — | CN | claimed |