Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 17/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Butylamine SCHEMBL4364111 | 1.00 | KIF11 (0.54) | KIF11KCNH2CYP3A4CYP2D6CYP2C9 | |
| Butylamine SCHEMBL1768235 | 0.95 | KIF11 (0.51) | KIF11KCNH2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL532733 | 0.87 | KIF11 (0.50) | KIF11KCNH2CYP3A4CYP2D6CYP2C9 | |
| Ethane SCHEMBL4197868 | 0.85 | KIF11 (0.46) | KIF11KCNH2CYP3A4CYP2D6CYP2C9 | |
| Ammonia Solution, Strong SCHEMBL8366919 | 0.85 | KIF11 (0.48) | KIF11KCNH2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL3623446 | 0.85 | KIF11 (0.48) | KIF11KCNH2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL5916213 | 0.85 | KIF11 (0.48) | KIF11KCNH2CYP3A4CYP2D6CYP2C9 | |
| Ammonia Solution, Strong SCHEMBL4205266 | 0.85 | KIF11 (0.48) | KIF11KCNH2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL29031297 | 0.85 | SIGMAR1 (0.43) | KIF11CYP3A4CYP2D6CYP2C9CYP2C19 | |
| Tetrabuthylammonium SCHEMBL3403042 | 0.85 | KIF11 (0.38) | KIF11KCNH2CYP3A4CYP2D6CYP2C9 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2766903-A1 | CHAIN TRANSFER REAGENTS IN POLYURETHANE-BASED PHOTOPOLYMER FORMULATIONS | Bayer Intellectual Property GmbH (DE) | 2014-08-20 | — | — | EP | disclosed |
| WO-2013053792-A1 | CHAIN TRANSFER REAGENTS IN POLYURETHANE-BASED PHOTOPOLYMER FORMULATIONS | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2013-04-18 | — | — | WO | disclosed |
| EP-2497082-A1 | FLUOROURETHANE AS AN ADDITIVE IN A PHOTOPOLYMER FORMULATION | Bayer MaterialScience AG (DE) | 2012-09-12 | — | — | EP | disclosed |
| WO-2011054795-A1 | FLUOROURETHANE AS AN ADDITIVE IN A PHOTOPOLYMER FORMULATION | BAYER MATERIALSCIENCE AG (DE) | 2011-05-12 | — | — | WO | disclosed |