Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11572447 | 1.00 | ABCB1 (0.47) | ABCB1 | |
| SCHEMBL8918158 | 0.85 | CA1 (0.49) | — | |
| SCHEMBL6244506 | 0.83 | MC4R (0.49) | — | |
| SCHEMBL5742609 | 0.83 | MAPT (0.51) | — | |
| SCHEMBL16707751 | 0.82 | — | — | |
| SCHEMBL13858916 | 0.79 | KCNH2 (0.47) | — | |
| SCHEMBL13972054 | 0.79 | S1PR5 (0.51) | ABCB1 | |
| SCHEMBL3764570 | 0.78 | HTR6 (0.54) | — | |
| SCHEMBL16488227 | 0.78 | HTR6 (0.54) | — | |
| SCHEMBL14948180 | 0.78 | ABCB1 (0.46) | ABCB1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012045007-A1 | METHOD OF PREPARATION OF (4 - {4 -ACETYLAMINO- 2 - [3- ( 2 - ISOPROPYL - THIAZOL - 4 - YLMETHYL) - 3 -METHYL - UREIDO] - BUTYRYL AMINO} -1 -BENZYL- 5 -PHENYL- PENTYL) -CARBAMIC ACID THIAZOL - 5 - YLMETHYL ESTER | GILEAD SCIENCES, INC. (US) | 2012-04-05 | — | — | WO | disclosed |