Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.50 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.44 |
| ▸ | KCNA5 | P22460 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.39 |
| ▸ | MIF | P14174 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4969094 | 1.00 | KDM4E (0.50) | KDM4EADRA2AADRA2CLMNAHIF1A | |
| SCHEMBL31143607 | 0.83 | CYP3A4 (0.48) | KDM4EADRA2ALMNAHIF1AALDH1A1 | |
| SCHEMBL20604265 | 0.83 | CYP3A4 (0.47) | KDM4EADRA2ALMNAHIF1AALDH1A1 | |
| SCHEMBL30887869 | 0.83 | CYP3A4 (0.47) | KDM4EADRA2ALMNAHIF1AALDH1A1 | |
| SCHEMBL31143650 | 0.83 | CYP3A4 (0.48) | KDM4EADRA2ALMNAHIF1AALDH1A1 | |
| SCHEMBL23610049 | 0.83 | CYP3A4 (0.48) | KDM4EADRA2ALMNAHIF1AALDH1A1 | |
| SCHEMBL7759775 | 0.83 | CYP3A4 (0.48) | KDM4EADRA2ALMNAHIF1AALDH1A1 | |
| SCHEMBL5954472 | 0.83 | CYP3A4 (0.47) | KDM4EADRA2ALMNAHIF1AALDH1A1 | |
| SCHEMBL9777431 | 0.83 | SLC6A2 (0.54) | KDM4ELMNAHIF1AALDH1A1CYP1A2 | |
| SCHEMBL7269148 | 0.80 | CYP3A4 (0.43) | KDM4EALDH1A1CYP1A2CYP3A4SLC6A2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0910564-B1 | D-AMINO ACID DERIVED INHIBITORS OF CYSTEINE AND SERINE PROTEASES | CEPHALON INC (US) | 2007-10-31 | — | — | EP | disclosed |
| EP-0910564-A1 | D-AMINO ACID DERIVED INHIBITORS OF CYSTEINE AND SERINE PROTEASES | CEPHALON, INC. (US) | 1999-04-28 | — | — | EP | disclosed |
| EP-0910564-A4 | — | — | 1999-04-28 | — | — | EP | disclosed |
| US-5852007-A | Cysteine and serine protease inhibitors containing D-amino acid at the P2 position, methods of making same, and methods of using same | CEPHALON, INC. (US) | 1998-12-22 | — | — | US | disclosed |
| WO-1997021690-A1 | D-AMINO ACID DERIVED INHIBITORS OF CYSTEINE AND SERINE PROTEASES | CEPHALON, INC. (US) | 1997-06-19 | — | — | WO | disclosed |