Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL23740150 | 1.00 | CETP (0.35) | CETPTSHR | |
| SCHEMBL28204470 | 0.92 | EPHX1 (0.37) | CETPTSHR | |
| SCHEMBL9208824 | 0.88 | EPHX1 (0.37) | CETPTSHR | |
| SCHEMBL9210570 | 0.88 | TSHR (0.32) | CETPTSHR | |
| SCHEMBL9843071 | 0.86 | EPHX1 (0.38) | TSHR | |
| SCHEMBL18594767 | 0.85 | CETP (0.36) | CETP | |
| SCHEMBL28770037 | 0.85 | TSHR (0.32) | TSHR | |
| SCHEMBL9213525 | 0.84 | EPHX1 (0.37) | CETPTSHR | |
| SCHEMBL11260424 | 0.84 | CETP (0.37) | CETPTSHR | |
| SCHEMBL11256415 | 0.84 | EPHX1 (0.37) | CETPTSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-3327603-A1 | METHOD AND DEVICE FOR CALCULATING ACID DISSOCIATION CONSTANT, AND PROGRAM | Fujitsu Limited (JP) | 2018-05-30 | — | — | EP | disclosed |