Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | NAMPT | P43490 | 2/20 | 0.34 |
| ▸ | GALK1 | P51570 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 2/20 | 0.33 |
| ▸ | ACHE | P22303 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL3855168 | 0.95 | ALDH1A1 (0.38) | HCAR3KDM4EALDH1A1LMNAKMT2A | |
| SCHEMBL3853097 | 0.92 | HCAR3 (0.43) | HCAR3KDM4EALDH1A1LMNAKMT2A | |
| SCHEMBL28848352 | 0.78 | KDM4E (0.46) | HCAR3KDM4EALDH1A1MAPK1L3MBTL1 | |
| SCHEMBL3520084 | 0.75 | MAPK1 (0.47) | KDM4EALDH1A1LMNAMAPK1L3MBTL1 | |
| SCHEMBL3860560 | 0.73 | ATM (0.51) | KDM4EALDH1A1LMNAKMT2ANAMPT | |
| SCHEMBL15391827 | 0.72 | CYP2C9 (0.56) | KDM4EALDH1A1LMNAMAPK1L3MBTL1 | |
| SCHEMBL15712178 | 0.70 | MAPK1 (0.39) | KDM4EALDH1A1MAPK1L3MBTL1TSHR | |
| SCHEMBL3849724 | 0.70 | PDE4A (0.42) | KDM4EALDH1A1LMNAL3MBTL1KMT2A | |
| SCHEMBL15391826 | 0.69 | CYP2C9 (0.56) | KDM4EALDH1A1LMNAMAPK1KMT2A | |
| SCHEMBL3517645 | 0.69 | HCAR2 (0.48) | KDM4EALDH1A1LMNAKMT2ASMN1; SMN2 |
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-1740575-A2 | PYRROLIDINE DERIVATIVES USEFUL AS BACE INHIBITORS | ELI LILLY AND COMPANY (US) | 2007-01-10 | — | — | EP | disclosed |
| WO-2005108358-A2 | PYRROLIDINE DERIVATIVES USEFUL AS BACE INHIBITORS | ELI LILLY AND COMPANY (US) | 2005-11-17 | — | — | WO | disclosed |