Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC7 | O00311 | 2/20 | 0.49 |
| ▸ | DBF4 | Q9UBU7 | 2/20 | 0.49 |
| ▸ | GRM6 | O15303 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 6/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 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 | |
|---|---|---|---|---|
| SCHEMBL17874036 | 0.88 | CDC7 (0.46) | CDC7DBF4GRM6ALDH1A1KDM4E | |
| SCHEMBL8946850 | 0.82 | KDM4E (0.62) | CDC7DBF4GRM6ALDH1A1KDM4E | |
| SCHEMBL7839276 | 0.79 | ALDH1A1 (0.39) | CDC7DBF4ALDH1A1KDM4ERAB9A | |
| SCHEMBL28486968 | 0.78 | CDC7 (0.50) | CDC7DBF4GRM6ALDH1A1KDM4E | |
| SCHEMBL17479069 | 0.76 | HCRTR1 (0.39) | ALDH1A1KDM4E | |
| SCHEMBL15515454 | 0.76 | CDC7 (0.43) | CDC7DBF4ALDH1A1KDM4ETP53 | |
| SCHEMBL17064231 | 0.75 | KMT2A (0.40) | ALDH1A1KDM4ERAB9AMAPTHPGD | |
| SCHEMBL18074580 | 0.72 | CTSA (0.41) | ALDH1A1 | |
| SCHEMBL19259491 | 0.72 | HDAC3 (0.43) | CDC7DBF4 | |
| SCHEMBL19894057 | 0.71 | TSHR (0.54) | ALDH1A1KDM4ERAB9AHSD17B10MAPT |
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-2016102438-A1 | PROCESS FOR THE PREPARATION OF 4-PHENYL-5-ALKOXYCARBONYL-2-THIAZOL-2-YL-1,4-DIHYDROPYRIMIDINE ANALOGUES | F. HOFFMANN-LA ROCHE AG (CH) | 2016-06-30 | — | — | WO | disclosed |
| WO-2016016196-A1 | NOVEL CHIRAL RESOLUTION OF 4-ARYL-2-THIAZOL-2-YL-1,4-DIHYDROPYRIMIDINE-5-CARBOXYLIC ACID ESTERS | F. HOFFMANN-LA ROCHE AG (CH) | 2016-02-04 | — | — | WO | disclosed |