Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 2/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | CASP3 | P42574 | 1/20 | 0.30 |
| ▸ | ABL1 | P00519 | 1/20 | 0.30 |
| ▸ | BCR | P11274 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17004603 | 1.00 | BACE1 (0.36) | BACE1PTGDR2KDM4EMAPK1SMN1; SMN2 | |
| SCHEMBL17004601 | 1.00 | BACE1 (0.36) | BACE1PTGDR2KDM4EMAPK1SMN1; SMN2 | |
| SCHEMBL21433323 | 0.91 | BACE1 (0.45) | BACE1PTGDR2MAPK1SMN1; SMN2LMNA | |
| SCHEMBL15991534 | 0.91 | BACE1 (0.45) | BACE1PTGDR2MAPK1SMN1; SMN2LMNA | |
| SCHEMBL2591587 | 0.90 | BACE1 (0.36) | BACE1PTGDR2MAPK1LMNAHPGD | |
| SCHEMBL2591584 | 0.90 | BACE1 (0.36) | BACE1PTGDR2MAPK1LMNAHPGD | |
| SCHEMBL2591589 | 0.90 | BACE1 (0.36) | BACE1PTGDR2MAPK1LMNAHPGD | |
| SCHEMBL15994984 | 0.88 | BACE1 (0.35) | BACE1PTGDR2SMN1; SMN2LMNAAAK1 | |
| SCHEMBL17364083 | 0.88 | PTGDR2 (0.38) | BACE1PTGDR2SMN1; SMN2LMNAALDH1A1 | |
| SCHEMBL18479203 | 0.87 | AAK1 (0.36) | BACE1PTGDR2LMNAAAK1 |
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-2297120-B1 | AMINODIHYDROTHIAZINE DERIVATIVES AS BACE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE | LILLY CO ELI (US) | 2015-08-19 | — | — | EP | disclosed |