Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 3/20 | 0.33 |
| ▸ | NOS1 | P29475 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL22802017 | 0.77 | CYP2A6 (0.44) | CYP2A6ALDH1A1ALOX15MAPK1TDP1 | |
| SCHEMBL2575115 | 0.77 | CYP2A6 (0.44) | CYP2A6ALDH1A1ALOX15MAPK1TDP1 | |
| SCHEMBL3201605 | 0.73 | CYP2A6 (0.57) | CYP2A6ALDH1A1ALOX15MAPK1TDP1 | |
| SCHEMBL5702435 | 0.71 | ACHE (0.53) | CYP2A6ALDH1A1TDP1CA2CA1 | |
| SCHEMBL18508 | 0.71 | — | — | |
| SCHEMBL6117653 | 0.69 | ACHE (0.45) | CA2NOS1CA1CES2CES1 | |
| SCHEMBL9245852 | 0.69 | CA1 (0.32) | CA2CA1 | |
| Fluoride Ion SCHEMBL11660219 | 0.69 | ACHE (0.50) | CYP2A6ALDH1A1TDP1CA2CA1 | |
| Hydrochloric Acid SCHEMBL11620241 | 0.69 | ACHE (0.50) | CYP2A6ALDH1A1TDP1CA2CA1 | |
| SCHEMBL245789 | 0.69 | CYP3A4 (0.50) | ALDH1A1ALOX15MAPK1CA2CA1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1066303-B1 | TRANSITION METAL COMPOUND CONTAINING CATIONIC GROUPS WHICH IS USED AS AN OLEFIN POLYMERIZATION CATALYST COMPONENT | BASELL POLYOLEFINE GMBH (DE) | 2003-09-10 | — | — | EP | claimed |
| US-6583238-B1 | Polypropylene having extraordinarily high stereospecificity and regiospecificity; | BASELL POLYOLEFINE GMBH (DE) | 2003-06-24 | — | — | US | claimed |
| US-6552210-B1 | Metallocenes which can be firmly fixed to support; gas phase polymerization | TARGOR GMBH (DE) | 2003-04-22 | — | — | US | claimed |
| EP-1066330-B1 | CATALYST SYSTEM, METHOD FOR THE PRODUCTION THEREOF, AND THE UTILIZATION THEREOF FOR THE POLYMERIZATION OF OLEFINS | BASELL POLYOLEFINE GMBH (DE) | 2002-02-06 | — | — | EP | claimed |
| CN-109554122-B | Curing adhesive for polarizing film, optical film, and image display device | 日东电工株式会社 | 2022-03-01 | — | — | CN | disclosed |
| US-6583238-B1 | Polypropylene having extraordinarily high stereospecificity and regiospecificity; | BASELL POLYOLEFINE GMBH (DE) | 2003-06-24 | — | — | US | disclosed |
| US-6552210-B1 | Metallocenes which can be firmly fixed to support; gas phase polymerization | TARGOR GMBH (DE) | 2003-04-22 | — | — | US | disclosed |