Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UGT2B17 | O75795 | 2/20 | 0.40 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.32 |
| ▸ | GRM5 | P41594 | 3/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | DRD1 | P21728 | 1/20 | 0.30 |
| ▸ | DRD4 | P21917 | 1/20 | 0.30 |
| ▸ | DRD5 | P21918 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL16363075 | 1.00 | UGT2B17 (0.40) | UGT2B17PGRCYP11B1CYP11B2GRM5 | |
| SCHEMBL16363088 | 1.00 | UGT2B17 (0.40) | UGT2B17PGRCYP11B1CYP11B2GRM5 | |
| SCHEMBL13881109 | 0.79 | AHR (0.37) | DRD2DRD1DRD4DRD5 | |
| SCHEMBL13881100 | 0.79 | AHR (0.37) | DRD2DRD1DRD4DRD5 | |
| SCHEMBL4514469 | 0.79 | SIGMAR1 (0.38) | — | |
| SCHEMBL1265230 | 0.78 | ACHE (0.33) | CYP11B1CYP11B2DRD2DRD1DRD4 | |
| SCHEMBL19657011 | 0.77 | MAOB (0.33) | DRD2DRD1DRD4DRD5 | |
| SCHEMBL4526093 | 0.74 | SIGMAR1 (0.37) | — | |
| SCHEMBL30491064 | 0.74 | CYP11B1 (0.36) | UGT2B17CYP11B1CYP11B2 | |
| SCHEMBL30449685 | 0.69 | ATM (0.34) | UGT2B17PGRKMT2A |
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-3016961-B1 | NOVEL RUTHENIUM CATALYSTS AND THEIR USE FOR ASYMMETRIC REDUCTION OF KETONES | BOEHRINGER INGELHEIM INT (DE) | 2017-11-15 | — | — | EP | disclosed |