Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.35 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.35 |
| ▸ | ESR1 | P03372 | 4/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL23014014 | 0.79 | CYP2C19 (0.48) | ALDH1A1RAB9AESR1ESR2TSHR | |
| SCHEMBL11681348 | 0.78 | ALDH1A1 (0.42) | ALDH1A1USP2RAB9ACYP19A1NR1H2 | |
| SCHEMBL5362887 | 0.77 | CYP19A1 (0.36) | ALDH1A1USP2RAB9ACYP19A1NR1H2 | |
| SCHEMBL5929626 | 0.76 | CYP2C19 (0.39) | ALDH1A1USP2RAB9ACYP19A1 | |
| SCHEMBL2794969 | 0.76 | CYP2C19 (0.39) | ALDH1A1USP2RAB9ACYP19A1 | |
| SCHEMBL13370709 | 0.73 | ESR1 (0.42) | ALDH1A1USP2RAB9ACYP19A1NR1H2 | |
| SCHEMBL22024005 | 0.72 | ESR1 (0.44) | USP2RAB9ACYP19A1ESR1ESR2 | |
| SCHEMBL27926650 | 0.72 | KIF11 (0.40) | ALDH1A1USP2RAB9ACYP19A1ESR1 | |
| SCHEMBL18470613 | 0.72 | KIF11 (0.40) | USP2RAB9ACYP19A1ESR1ESR2 | |
| SCHEMBL27557013 | 0.71 | USP2 (0.45) | USP2RAB9ACYP19A1NR1H2NR1H3 |
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-2022220725-A1 | LPXH INHIBITORS AS ANTI-INFECTIVE AGENTS | ZAMARATSKI EDOUARD (SE) | 2022-10-20 | — | — | WO | disclosed |