Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSD | P07339 | 6/20 | 0.42 |
| ▸ | BACE1 | P56817 | 6/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.40 |
| ▸ | KLK7 | P49862 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.36 |
| ▸ | PPIB | P23284 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7032960 | 0.79 | HTR2B (0.42) | CTSDBACE1KDM4EKLK7ALDH1A1 | |
| SCHEMBL14862455 | 0.78 | BACE1 (0.49) | CTSDBACE1AKR1B1CNR2MAPT | |
| SCHEMBL20480067 | 0.74 | MAPT (0.39) | CTSDBACE1KDM4EAKR1B1ALDH1A1 | |
| SCHEMBL10576683 | 0.73 | PDE7A (0.44) | CTSDBACE1AKR1B1MAPT | |
| SCHEMBL10749114 | 0.73 | AKR1B1 (0.40) | CTSDBACE1KDM4EAKR1B1KLK7 | |
| SCHEMBL16109188 | 0.70 | CA2 (0.44) | KDM4EKLK7ALDH1A1MAPTTDP1 | |
| SCHEMBL2862345 | 0.69 | ALDH1A1 (0.47) | KDM4EAKR1B1ALDH1A1CNR2MAPT | |
| SCHEMBL9584799 | 0.68 | CA12 (0.40) | CTSDBACE1KDM4EKLK7ALDH1A1 | |
| SCHEMBL21950002 | 0.68 | MAPT (0.55) | MAPTSMN1; SMN2 | |
| SCHEMBL4972696 | 0.68 | CA2 (0.49) | MAPTHTR1AHTR2BSIGMAR1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6596758-B1 | Treatment of dislipidaemias, atherosclerosis and diabetes, to pharmaceutical compositions comprising them and to processes allowing the preparation of these compounds. | MERCK PATENT GMBH (DE) | 2003-07-22 | — | — | US | disclosed |
| EP-1140893-B1 | BENZOPYRANS AND BENZOXEPINES, PHARMACEUTICAL COMPOSITIONS COMPRISING THEM AND PREPARATION PROCESS | MERCK PATENT GMBH (DE) | 2003-03-05 | — | — | EP | disclosed |