Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.34 |
| ▸ | RELA | Q04206 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | APLNR | P35414 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5156805 | 0.90 | L3MBTL1 (0.35) | ALDH1A1L3MBTL1TSHRPOLBHPGD | |
| SCHEMBL3853798 | 0.86 | ALDH1A1 (0.53) | ALDH1A1L3MBTL1LMNAMAPTCYP1A2 | |
| SCHEMBL3853797 | 0.83 | HCAR3 (0.48) | ALDH1A1L3MBTL1LMNAMAPTTSHR | |
| SCHEMBL3855292 | 0.82 | LMNA (0.37) | ALDH1A1L3MBTL1LMNAMAPTNFKB1 | |
| SCHEMBL3853800 | 0.76 | TSHR (0.46) | ALDH1A1L3MBTL1LMNATSHRSMN1; SMN2 | |
| SCHEMBL6570774 | 0.76 | PLA2G2A (0.41) | ALDH1A1L3MBTL1LMNAMAPTTSHR | |
| SCHEMBL3861592 | 0.71 | MEN1 (0.48) | ALDH1A1L3MBTL1NPC1HPGDHCAR3 | |
| SCHEMBL6570768 | 0.71 | KDM4E (0.44) | ALDH1A1L3MBTL1LMNAMAPTCYP1A2 | |
| SCHEMBL3860560 | 0.69 | ATM (0.51) | ALDH1A1LMNACYP1A2CYP2C9CYP2C19 | |
| SCHEMBL5158669 | 0.68 | LMNA (0.39) | ALDH1A1LMNAMAPTMEN1KMT2A |
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 |