Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOD2 | Q9HC29 | 4/20 | 0.59 |
| ▸ | NOD1 | Q9Y239 | 4/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | CCR2 | P41597 | 1/20 | 0.55 |
| ▸ | BCL2 | P10415 | 1/20 | 0.49 |
| ▸ | BID | P55957 | 1/20 | 0.49 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.49 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.49 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.49 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.49 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.49 |
| ▸ | HDAC9 | Q9UKV0 | 4/20 | 0.49 |
| ▸ | HDAC5 | Q9UQL6 | 4/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL9617940 | 0.84 | NOD2 (0.64) | NOD2NOD1ALDH1A1LMNAMAPT | |
| SCHEMBL3056166 | 0.82 | ALDH1A1 (0.62) | NOD2NOD1ALDH1A1LMNAMAPT | |
| SCHEMBL31599460 | 0.82 | CCR2 (0.72) | NOD2NOD1ALDH1A1LMNAMAPT | |
| SCHEMBL6864420 | 0.82 | ALDH1A1 (0.73) | NOD2NOD1ALDH1A1LMNAMAPT | |
| SCHEMBL4121234 | 0.82 | CCR2 (0.72) | NOD2NOD1ALDH1A1LMNAMAPT | |
| SCHEMBL2542152 | 0.81 | NOD2 (0.86) | NOD2NOD1ALDH1A1LMNAMAPT | |
| Hydrochloric Acid SCHEMBL4119324 | 0.80 | CCR2 (0.71) | NOD2NOD1ALDH1A1LMNAMAPT | |
| SCHEMBL3836440 | 0.79 | ALDH1A1 (0.62) | NOD2NOD1ALDH1A1LMNAMAPT | |
| SCHEMBL4118405 | 0.77 | NOD2 (0.56) | NOD2NOD1ALDH1A1LMNAMAPT | |
| SCHEMBL9472013 | 0.77 | ALDH1A1 (0.60) | NOD2NOD1ALDH1A1LMNAMAPT |
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-1898927-A2 | NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS | Merck & Co., Inc. (US) | 2008-03-19 | — | — | EP | disclosed |
| WO-2007002481-A2 | NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS | MERCK & CO., INC. (US) | 2007-01-04 | — | — | WO | disclosed |