Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MPI | P34949 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.36 |
| ▸ | MDM2 | Q00987 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | LDHA | P00338 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.33 |
| ▸ | DHODH | Q02127 | 1/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 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 | |
|---|---|---|---|---|
| SCHEMBL2855526 | 0.96 | CYP1A2 (0.38) | ALDH1A1KDM4EMEN1MAPTKMT2A | |
| SCHEMBL4631569 | 0.80 | CYP1A2 (0.43) | ALDH1A1KDM4EMEN1MAPTKMT2A | |
| SCHEMBL2855346 | 0.79 | CYP3A4 (0.51) | ALDH1A1KDM4EMEN1MAPTKMT2A | |
| SCHEMBL2847202 | 0.78 | ALDH1A1 (0.51) | ALDH1A1KDM4EMEN1MAPTKMT2A | |
| SCHEMBL2851214 | 0.72 | ALDH1A1 (0.47) | ALDH1A1KDM4EMEN1MAPTKMT2A | |
| SCHEMBL29954957 | 0.72 | ALDH1A1 (0.47) | ALDH1A1KDM4EMEN1MAPTKMT2A | |
| SCHEMBL2849385 | 0.69 | CYP1A2 (0.53) | ALDH1A1KDM4EMEN1MAPTKMT2A | |
| SCHEMBL11153472 | 0.66 | ERN1 (0.51) | ALDH1A1KDM4EMAPTKMT2ASMN1; SMN2 | |
| SCHEMBL22445783 | 0.65 | CYP1A2 (0.47) | ALDH1A1KDM4EMEN1MAPTKMT2A | |
| SCHEMBL2849379 | 0.65 | ALDH1A1 (0.56) | ALDH1A1KDM4EMAPTSMN1; SMN2PSMB5 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1924558-A1 | AN ANTIMALARIAL BAYLIS-HILLMAN ADDUCTS AND A PROCESS FOR THE PREPARATION THEREOF | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2008-05-28 | — | — | EP | claimed |
| WO-2007032016-A1 | AN ANTIMALARIAL BAYLIS-HILLMAN ADDUCTS AND A PROCESS FOR THE PREPARATION THEREOF | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2007-03-22 | — | — | WO | claimed |