Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 10/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | MMP10 | P09238 | 5/20 | 0.35 |
| ▸ | MMP8 | P22894 | 5/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.31 |
| ▸ | CCR1 | P32246 | 1/20 | 0.31 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.31 |
| ▸ | SCD | O00767 | 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 | |
|---|---|---|---|---|
| SCHEMBL9942940 | 0.94 | CYP2C9 (0.39) | CYP2C9MMP13KCNH2MMP10MMP8 | |
| SCHEMBL9905237 | 0.93 | CYP2C9 (0.41) | CYP2C9MMP13KCNH2MMP10MMP8 | |
| SCHEMBL9901023 | 0.93 | CYP2C9 (0.41) | CYP2C9MMP13KCNH2MMP10MMP8 | |
| SCHEMBL9942979 | 0.93 | CYP2C9 (0.41) | CYP2C9MMP13KCNH2MMP10MMP8 | |
| SCHEMBL9942909 | 0.93 | CYP2C9 (0.41) | CYP2C9MMP13KCNH2MMP10MMP8 | |
| SCHEMBL9904945 | 0.91 | CYP2C9 (0.40) | CYP2C9MMP13KCNH2MMP10MMP8 | |
| SCHEMBL9900910 | 0.91 | CYP2C9 (0.42) | CYP2C9MMP13KCNH2MMP10MMP8 | |
| SCHEMBL9943009 | 0.91 | CYP2C9 (0.39) | CYP2C9MMP13KCNH2MMP10MMP8 | |
| SCHEMBL16063234 | 0.91 | CYP2C9 (0.39) | CYP2C9MMP13KCNH2MMP10MMP8 | |
| SCHEMBL9900842 | 0.91 | CYP2C9 (0.39) | CYP2C9MMP13KCNH2MMP10MMP8 |
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-2012078834-A1 | HIV INTEGRASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-06-14 | — | — | WO | disclosed |