Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC7 | O00311 | 2/20 | 0.36 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.36 |
| ▸ | SIRT1 | Q96EB6 | 2/20 | 0.34 |
| ▸ | TYMS | P04818 | 2/20 | 0.34 |
| ▸ | PARP1 | P09874 | 6/20 | 0.32 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.31 |
| ▸ | AURKA | O14965 | 1/20 | 0.31 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.31 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.31 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.31 |
| ▸ | PIM1 | P11309 | 1/20 | 0.31 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.31 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.31 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27694235 | 0.89 | KDR (0.37) | CDC7MAPK8SIRT1TYMSPARP1 | |
| SCHEMBL27694282 | 0.86 | EDNRA (0.44) | CDC7MAPK8PARP1 | |
| SCHEMBL27675744 | 0.85 | CDC7 (0.37) | CDC7MAPK8SIRT1TYMSPARP1 | |
| SCHEMBL27694283 | 0.84 | BRD4 (0.34) | CDC7MAPK8SIRT1PARP1BCAT2 | |
| SCHEMBL28763133 | 0.84 | CHEK1 (0.33) | PARP1BCAT2PIM1CSNK2BCSNK2A1 | |
| SCHEMBL27675745 | 0.83 | BCL2L1 (0.36) | SIRT1PARP1BCAT2PIM1CSNK2B | |
| SCHEMBL27675746 | 0.83 | CDC7 (0.39) | CDC7SIRT1PARP1BCAT2RPS6KB1 | |
| SCHEMBL3175305 | 0.82 | TYMS (0.37) | CDC7MAPK8TYMSPARP1KDR | |
| SCHEMBL28763131 | 0.80 | PDE7A (0.37) | CDC7SIRT1PARP1BCAT2ALDH1A1 | |
| SCHEMBL27694287 | 0.79 | NPC1 (0.41) | CDC7MAPK8SIRT1PARP1BCAT2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-100562521-C | Substituted thienopyrrole carboxylic acid amides, pyrrolothiazole carboxylic acid amides, and related analogs as inhibitors of casein kinase ie | AVENTIS PHARMA INC (US) | 2009-11-25 | — | — | CN | disclosed |
| CN-101001861-A | Substituted thienopyrrole carboxylic acid amides, pyrrolothiazole carboxylic acid amides, and related analogs as inhibitors of casein kinase i epsilon | AVENTIS PHARMA INC (US) | 2007-07-18 | — | — | CN | disclosed |