Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPKAPK2 | P49137 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | GFER | P55789 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.42 |
| ▸ | CCNC | P24863 | 2/20 | 0.41 |
| ▸ | CDK8 | P49336 | 2/20 | 0.41 |
| ▸ | HASPIN | Q8TF76 | 2/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL903731 | 0.70 | ALDH1A1 (0.43) | KDM4EALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL1985544 | 0.70 | MEN1 (0.51) | MAPKAPK2KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL18215247 | 0.69 | KMT2A (0.45) | ALDH1A1MEN1KMT2AMAPTHSD17B10 | |
| SCHEMBL29391519 | 0.67 | ALDH1A1 (1.00) | KDM4EALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL2597652 | 0.67 | ALDH1A1 (1.00) | KDM4EALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL13391226 | 0.67 | CA1 (0.42) | KDM4EALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL1986560 | 0.65 | CCNB2 (0.56) | KDM4EALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL6365456 | 0.64 | MEN1 (0.65) | KDM4EALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL14772234 | 0.64 | CCNB2 (0.41) | KDM4EALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL903534 | 0.64 | ALOX5 (0.53) | KDM4EALDH1A1MEN1KMT2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012041227-A1 | TETRACYCLIC HETEROCYCLE COMPOUNDS FOR TREATING HEPATITIS C VIRAL INFECTION | MERCK SHARP & DOHME CORP. (US) | 2012-04-05 | — | — | WO | disclosed |
| WO-2012040924-A1 | FUSED TETRACYCLIC HETEROCYCLE COMPOUNDS AND METHODS OF USE THEREOF FOR TREATMENT OF VIRAL DISEASES | MERCK SHARP & DOHME CORP. (US) | 2012-04-05 | — | — | WO | disclosed |