Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP9 | P14780 | 6/20 | 0.32 |
| ▸ | MMP1 | P03956 | 4/20 | 0.32 |
| ▸ | MMP13 | P45452 | 4/20 | 0.32 |
| ▸ | NAMPT | P43490 | 1/20 | 0.31 |
| ▸ | ADAM17 | P78536 | 3/20 | 0.31 |
| ▸ | HTR6 | P50406 | 4/20 | 0.30 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.30 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.30 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.30 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | MMP2 | P08253 | 1/20 | 0.30 |
| ▸ | USP30 | Q70CQ3 | 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 | |
|---|---|---|---|---|
| SCHEMBL4789904 | 0.93 | MMP1 (0.36) | MMP9MMP1MMP13NAMPTADAM17 | |
| SCHEMBL4792892 | 0.90 | — | — | |
| SCHEMBL4791519 | 0.89 | NAMPT (0.32) | NAMPT | |
| SCHEMBL1278276 | 0.89 | NAMPT (0.38) | MMP9MMP1MMP13NAMPTHTR6 | |
| SCHEMBL4422713 | 0.87 | — | — | |
| SCHEMBL4791384 | 0.86 | — | — | |
| Fumaric Acid SCHEMBL4791584 | 0.82 | NAMPT (0.35) | MMP9MMP1MMP13NAMPTHTR6 | |
| SCHEMBL4792897 | 0.82 | PTGDR2 (0.33) | NAMPTADAM17CHRNB4CHRNA3 | |
| SCHEMBL4791521 | 0.81 | NAMPT (0.36) | MMP9MMP1MMP13NAMPT | |
| SCHEMBL4791781 | 0.81 | PDE10A (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1919865-A1 | 1-HETEROCYCLYLSULFONYL, 2-AMINOMETHYL, 5- (HETERO-) ARYL SUBSTITUTED 1-H-PYRROLE DERIVATIVES AS ACID SECRETION INHIBITORS | Takeda Pharmaceutical Company Limited (JP) | 2008-05-14 | — | — | EP | disclosed |
| WO-2007026916-A1 | 1-HETEROCYCLYLSULFONYL, 2-AMINOMETHYL, 5- (HETERO-) ARYL SUBSTITUTED 1-H-PYRROLE DERIVATIVES AS ACID SECRETION INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-03-08 | — | — | WO | disclosed |