Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 13/20 | 0.43 |
| ▸ | CCNA2 | P20248 | 12/20 | 0.43 |
| ▸ | CDK2 | P24941 | 12/20 | 0.43 |
| ▸ | CCNA1 | P78396 | 12/20 | 0.43 |
| ▸ | GRM4 | Q14833 | 4/20 | 0.42 |
| ▸ | RPS6KA4 | O75676 | 1/20 | 0.39 |
| ▸ | STK10 | O94804 | 1/20 | 0.39 |
| ▸ | LATS1 | O95835 | 1/20 | 0.39 |
| ▸ | PAK4 | O96013 | 1/20 | 0.39 |
| ▸ | RET | P07949 | 1/20 | 0.39 |
| ▸ | PIM1 | P11309 | 1/20 | 0.39 |
| ▸ | NQO2 | P16083 | 1/20 | 0.39 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.39 |
| ▸ | MARK3 | P27448 | 1/20 | 0.39 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.39 |
| ▸ | TGFBR2 | P37173 | 1/20 | 0.39 |
| ▸ | PRKCI | P41743 | 1/20 | 0.39 |
| ▸ | PSMC4 | P43686 | 1/20 | 0.39 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.39 |
| ▸ | MAP2K5 | Q13163 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL15007203 | 1.00 | CHEK1 (0.43) | CHEK1CCNA2CDK2CCNA1GRM4 | |
| SCHEMBL15007204 | 1.00 | CHEK1 (0.43) | CHEK1CCNA2CDK2CCNA1GRM4 | |
| SCHEMBL15007075 | 0.87 | CHEK1 (0.40) | CHEK1CCNA2CDK2CCNA1RPS6KA4 | |
| SCHEMBL15031456 | 0.87 | CHEK1 (0.40) | CHEK1CCNA2CDK2CCNA1RPS6KA4 | |
| SCHEMBL15007076 | 0.87 | CHEK1 (0.40) | CHEK1CCNA2CDK2CCNA1RPS6KA4 | |
| Bicarbonate SCHEMBL17836487 | 0.87 | CHEK1 (0.44) | CHEK1CCNA2CDK2CCNA1GRM4 | |
| SCHEMBL15031423 | 0.84 | CHEK1 (0.50) | CHEK1CCNA2CDK2CCNA1RPS6KA4 | |
| SCHEMBL31358 | 0.84 | CHEK1 (0.50) | CHEK1CCNA2CDK2CCNA1RPS6KA4 | |
| SCHEMBL31357 | 0.84 | CHEK1 (0.50) | CHEK1CCNA2CDK2CCNA1RPS6KA4 | |
| SCHEMBL42497 | 0.81 | CHEK1 (0.44) | CHEK1CCNA2CDK2CCNA1GRM4 |
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-8883801-B2 | Substituted pyrazolo[1,5-a]pyrimidines as mTOR inhibitors | MERCK SHARP & DOHME CORP. (US) | 2014-11-11 | — | — | US | disclosed |
| US-8883801-B2 | Substituted pyrazolo[1,5-a]pyrimidines as mTOR inhibitors | MERCK SHARP & DOHME CORP. (US) | 2014-11-11 | — | — | US | disclosed |