Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | THRA | P10827 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 2/20 | 0.39 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.39 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.34 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.33 |
| ▸ | PTGER3 | P43115 | 2/20 | 0.33 |
| ▸ | PTGER2 | P43116 | 2/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.33 |
| ▸ | TYR | P14679 | 1/20 | 0.33 |
| ▸ | CDK4 | P11802 | 1/20 | 0.32 |
| ▸ | CCND1 | P24385 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL12802118 | 1.00 | CYP3A4 (0.40) | CYP3A4CYP2D6CYP2C9THRATHRB | |
| SCHEMBL12802288 | 0.89 | CDK4 (0.33) | THRATHRBLIPGCDK4CCND1 | |
| SCHEMBL12802287 | 0.89 | CDK4 (0.33) | THRATHRBLIPGCDK4CCND1 | |
| SCHEMBL113477 | 0.83 | CDK4 (0.48) | CYP3A4CYP2D6CYP2C9THRATHRB | |
| SCHEMBL2938850 | 0.83 | CDK4 (0.48) | CYP3A4CYP2D6CYP2C9THRATHRB | |
| SCHEMBL30918142 | 0.83 | CDK4 (0.48) | CYP3A4CYP2D6CYP2C9THRATHRB | |
| SCHEMBL28869 | 0.82 | CYP3A4 (0.44) | CYP3A4CYP2D6CYP2C9THRATHRB | |
| SCHEMBL29480441 | 0.82 | CYP3A4 (0.44) | CYP3A4CYP2D6CYP2C9THRATHRB | |
| SCHEMBL14452362 | 0.82 | CDK4 (0.38) | PTGER4PTGER3PTGER2CDK4CCND1 | |
| SCHEMBL12802431 | 0.82 | CDK4 (0.38) | PTGER4PTGER3PTGER2CDK4CCND1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9587042-B2 | Process for producing modified conjugated diene-based polymer, modified conjugated diene-based polymer, and polymer composition | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2017-03-07 | — | — | US | disclosed |
| US-8933165-B2 | Method for producing modified conjugated diene-based polymer, and method for producing polymer composition | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2015-01-13 | — | — | US | disclosed |
| US-8835564-B2 | Method for producing modified conjugated diene-based polymer, and method for producing polymer composition | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2014-09-16 | — | — | US | disclosed |
| US-20140088242-A1 | METHOD FOR PRODUCING MODIFIED CONJUGATED DIENE-BASED POLYMER, AND METHOD FOR PRODUCING POLYMER COMPOSITION | ZEON CORPORATION (JP) | 2014-03-27 | — | — | US | disclosed |
| US-20140088256-A1 | METHOD FOR PRODUCING MODIFIED CONJUGATED DIENE-BASED POLYMER, AND METHOD FOR PRODUCING POLYMER COMPOSITION | ZEON CORPORATION (JP) | 2014-03-27 | — | — | US | disclosed |
| US-20120252966-A1 | PROCESS FOR PRODUCING MODIFIED CONJUGATED DIENE-BASED POLYMER, MODIFIED CONJUGATED DIENE-BASED POLYMER, AND POLYMER COMPOSITION | SUMITOMO CHEMICAL COMPANY, LIMITED | 2012-10-04 | — | — | US | disclosed |