Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.36 |
| ▸ | TMPRSS15 | P98073 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6831000 | 0.83 | BCHE (0.43) | GAATDP1KDM4EMAPTPRSS1 | |
| SCHEMBL6828835 | 0.80 | LMNA (0.44) | SMN1; SMN2LMNATDP1KDM4EMAPT | |
| SCHEMBL6831122 | 0.78 | LMNA (0.50) | LMNAGAAMAPTCYP2C9ALDH1A1 | |
| SCHEMBL6829229 | 0.73 | ALDH1A1 (0.48) | SMN1; SMN2LMNAHTTTDP1KDM4E | |
| SCHEMBL6925215 | 0.73 | PRSS1 (0.40) | PRSS1TMPRSS15KMT2A | |
| SCHEMBL6826137 | 0.72 | TMPRSS15 (0.41) | TSHRTDP1KDM4EPRSS1TMPRSS15 | |
| SCHEMBL7131617 | 0.72 | CYP2A6 (0.38) | SMN1; SMN2LMNACYP2A6GAAMAPT | |
| SCHEMBL2226671 | 0.72 | NPSR1 (0.53) | SMN1; SMN2LMNATSHRTDP1KDM4E | |
| SCHEMBL6826110 | 0.71 | PRSS1 (0.35) | PRSS1TMPRSS15 | |
| SCHEMBL2653044 | 0.71 | HDAC3 (0.55) | SMN1; SMN2LMNATSHRGAATDP1 |
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 |