Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 4/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
| ▸ | F2R | P25116 | 6/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | CNR2 | P34972 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | SMO | Q99835 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL18478027 | 0.89 | F2R (0.49) | PTGESHDAC6F2RCA1CA2 | |
| SCHEMBL15033692 | 0.81 | PTGES (0.52) | PTGESHDAC6F2RCA1CA2 | |
| SCHEMBL16671197 | 0.79 | PTGES (0.51) | PTGESHDAC6F2RCA1CA2 | |
| SCHEMBL671821 | 0.79 | CA1 (0.52) | PTGESHDAC6F2RCA1CA2 | |
| SCHEMBL17199049 | 0.78 | PTGES (0.59) | PTGESHDAC6F2RCA1CA2 | |
| SCHEMBL1671704 | 0.78 | PTGES (0.59) | PTGESHDAC6CA1CA2CA7 | |
| SCHEMBL16671026 | 0.78 | PTGES (0.59) | PTGESHDAC6F2RCA1CA2 | |
| SCHEMBL11978600 | 0.78 | HDAC6 (0.51) | PTGESHDAC6F2RCA1CA2 | |
| SCHEMBL16670980 | 0.77 | PTGES (0.49) | PTGESHDAC6F2RCA1CA2 | |
| SCHEMBL15541065 | 0.77 | CA1 (0.50) | PTGESHDAC6F2RCA1CA2 |
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-3456713-A1 | PROCESS FOR THE PREPARATION OF TRIAZINE DERIVATIVES | Japan Tobacco Inc. (JP) | 2019-03-20 | — | — | EP | disclosed |