Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 9/20 | 0.47 |
| ▸ | CES1 | P23141 | 9/20 | 0.47 |
| ▸ | LMNA | P02545 | 4/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CPN1 | P15169 | 1/20 | 0.39 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27489899 | 0.88 | CES2 (0.47) | CES2CES1LMNAMAPK1KDM4E | |
| SCHEMBL3521745 | 0.81 | LMNA (0.47) | CES2CES1LMNAMAPK1KDM4E | |
| SCHEMBL650572 | 0.80 | CES2 (0.68) | CES2CES1LMNAMAPK1KDM4E | |
| SCHEMBL30013497 | 0.80 | CES2 (0.68) | CES2CES1LMNAMAPK1KDM4E | |
| SCHEMBL8768406 | 0.79 | LMNA (0.45) | CES2CES1LMNAMAPK1KDM4E | |
| SCHEMBL27719249 | 0.79 | CES2 (0.51) | CES2CES1LMNAMAPK1KDM4E | |
| SCHEMBL27939668 | 0.78 | CES2 (0.47) | CES2CES1LMNAMAPK1KDM4E | |
| SCHEMBL27466007 | 0.78 | LMNA (0.47) | CES2CES1LMNAMAPK1KDM4E | |
| SCHEMBL11246241 | 0.78 | CPS1 (0.50) | CES2CES1LMNAMAPK1ALDH1A1 | |
| SCHEMBL17709653 | 0.78 | ALDH1A1 (0.60) | CES2CES1LMNAMAPK1KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018048882-A9 | POSITRON IMAGING TOMOGRAPHY IMAGING AGENT COMPOSITION AND METHOD FOR BACTERIAL INFECTION | THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) | 2019-01-10 | — | — | WO | disclosed |
| WO-2018048882-A1 | POSITRON IMAGING TOMOGRAPHY IMAGING AGENT COMPOSITION AND METHOD FOR BACTERIAL INFECTION | THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) | 2018-03-15 | — | — | WO | disclosed |