Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 2/20 | 0.46 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.44 |
| ▸ | PRKCZ | Q05513 | 6/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | NRAS | P01111 | 1/20 | 0.40 |
| ▸ | FLT3 | P36888 | 1/20 | 0.40 |
| ▸ | ACVR1B | P36896 | 1/20 | 0.38 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.38 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27981561 | 0.93 | CHEK1 (0.44) | CHEK1PDE7APRKCZACVR1BTGFBR1 | |
| SCHEMBL27981876 | 0.89 | PDE7A (0.47) | CHEK1PDE7APRKCZCHRNB2CHRNA4 | |
| SCHEMBL4697359 | 0.89 | PRKCZ (0.40) | CHEK1PDE7APRKCZCHRNB2CHRNA4 | |
| SCHEMBL27981853 | 0.84 | PRKCZ (0.41) | PRKCZCHRNB2CHRNA4ROCK1 | |
| SCHEMBL28813994 | 0.81 | CHEK1 (0.44) | CHEK1TGFBR1ACVR1 | |
| SCHEMBL27981568 | 0.81 | CHEK1 (0.37) | CHEK1TGFBR1ACVR1 | |
| SCHEMBL27981845 | 0.80 | CYP1A1 (0.35) | CHEK1KCNH2 | |
| SCHEMBL218696 | 0.80 | PDE7A (0.46) | CHEK1PDE7APRKCZNRASFLT3 | |
| SCHEMBL27981858 | 0.80 | CHEK1 (0.45) | CHEK1TGFBR1ACVR1 | |
| Ammonia Solution, Strong SCHEMBL250660 | 0.79 | PDE7A (0.48) | CHEK1PDE7APRKCZNRASFLT3 |
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-101316853-B | Benzothiazole and thiazolopyridine as SIRTUIN modulators | SIRTRIS PHARMACEUTICALS INC | 2014-09-24 | — | — | CN | disclosed |
| US-8178536-B2 | Sirtuin modulating compounds | SIRTRIS PHARMACEUTICALS, INC. (US) | 2012-05-15 | — | — | US | disclosed |