Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.51 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CRHBP | P24387 | 1/20 | 0.41 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.41 |
| ▸ | SRC | P12931 | 1/20 | 0.39 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.38 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.34 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7700919 | 0.83 | SRC (0.37) | ESR1ESR2LMNAALDH1A1SRC | |
| SCHEMBL11082448 | 0.83 | ESR1 (0.41) | ESR1ESR2LMNAALDH1A1KDM4E | |
| SCHEMBL10688255 | 0.81 | KMT2A (0.38) | ESR1ESR2LMNAALDH1A1KDM4E | |
| SCHEMBL130469 | 0.79 | PDCD1 (0.47) | LMNAALDH1A1KDM4EHPGDTP53 | |
| SCHEMBL28752431 | 0.77 | ESR1 (0.59) | ESR1ESR2LMNAALDH1A1KDM4E | |
| SCHEMBL7258105 | 0.74 | ESR1 (0.67) | ESR1ESR2LMNAALDH1A1KDM4E | |
| SCHEMBL28674746 | 0.74 | ESR1 (0.85) | ESR1ESR2LMNAALDH1A1KDM4E | |
| SCHEMBL20483494 | 0.74 | ESR1 (0.79) | ESR1ESR2LMNAALDH1A1KDM4E | |
| SCHEMBL28058117 | 0.74 | ESR1 (0.61) | ESR1ESR2LMNAALDH1A1KDM4E | |
| SCHEMBL6953946 | 0.73 | MAPT (0.41) | LMNAALDH1A1KDM4EHPGDCYP2D6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2003072537-A2 | SELECTIVE PROTEIN TYROSINE PHOSPHATATASE INHIBITORS | ABBOTT LABORATORIES (US) | 2003-09-04 | — | — | WO | disclosed |
| EP-0005889-B1 | PROCESS FOR THE PREPARATION OF BETA-LACTAM DERIVATIVES, THE NOVEL DERIVATIVES SO OBTAINABLE AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | Technobiotic Ltd. (CH) | 1982-06-16 | — | — | EP | disclosed |
| EP-0005889-A1 | Process for the preparation of beta-lactam derivatives, the novel derivatives so obtainable and pharmaceutical compositions containing them | Technobiotic Ltd. (CH) | 1979-12-12 | — | — | EP | disclosed |