Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.34 |
| ▸ | DHODH | Q02127 | 5/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.33 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL2851318 | 0.85 | KDM4E (0.52) | CASP1KDM4ESMN1; SMN2LMNADHODH | |
| SCHEMBL2853211 | 0.83 | L3MBTL1 (0.39) | KDM4ELMNAPDE10AADORA2AADORA1 | |
| SCHEMBL2851771 | 0.79 | CASP1 (0.39) | CASP1KDM4ELMNAPDE10ADHODH | |
| SCHEMBL2849135 | 0.77 | CASP1 (0.56) | CASP1KDM4ESMN1; SMN2LMNADHODH | |
| SCHEMBL13500074 | 0.75 | SQOR (0.33) | KDM4ESMN1; SMN2LMNAPDE10AADORA2A | |
| SCHEMBL2849134 | 0.74 | ALDH1A1 (0.51) | KDM4ESMN1; SMN2ALDH1A1TDP1L3MBTL1 | |
| SCHEMBL2851215 | 0.73 | KDM4E (0.33) | KDM4EACMSDTDP1EGFR | |
| SCHEMBL2853119 | 0.68 | CASP1 (0.47) | CASP1KDM4ESMN1; SMN2LMNADHODH | |
| SCHEMBL2850940 | 0.66 | CASP1 (0.43) | CASP1LMNAPDE10ADHODHALDH1A1 | |
| SCHEMBL2851683 | 0.66 | EGFR (0.30) | EGFR |
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 |
|---|---|---|---|---|---|---|---|
| EP-1924558-B1 | AN ANTIMALARIAL BAYLIS-HILLMAN ADDUCTS AND A PROCESS FOR THE PREPARATION THEREOF | COUNCIL SCIENT IND RES (IN) | 2010-01-13 | — | — | EP | claimed |