Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.32 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | AR | P10275 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3125619 | 0.80 | CHRM2 (0.31) | CHRM2CHRM4CHRM1CHRM3CYP2C19 | |
| SCHEMBL7433974 | 0.79 | POLB (0.35) | HTT | |
| SCHEMBL2242442 | 0.68 | ALDH1A1 (0.38) | CYP19A1CHRM2CHRM4CHRM1CHRM3 | |
| SCHEMBL28510806 | 0.67 | CHRM2 (0.37) | CYP19A1CHRM2CHRM4CHRM1CHRM3 | |
| SCHEMBL1332682 | 0.67 | TSHR (0.42) | CHRM2CHRM4CHRM1CHRM3CYP2C19 | |
| SCHEMBL20787030 | 0.66 | ALDH1A1 (0.36) | CHRM2CHRM4CHRM1CHRM3CYP2C19 | |
| SCHEMBL27575865 | 0.65 | HSD17B10 (0.44) | CHRM2CHRM4CHRM1CHRM3CYP2C19 | |
| SCHEMBL11582739 | 0.64 | ALDH1A1 (0.40) | CHRM2CHRM4CHRM1CHRM3LMNA | |
| SCHEMBL12215928 | 0.64 | CHRM2 (0.41) | CYP19A1CHRM2CHRM4CHRM1CHRM3 | |
| SCHEMBL7362669 | 0.63 | POLB (0.32) | ALDH1A1HTT |
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 |
|---|---|---|---|---|---|---|---|
| US-5808056-A | Process for preparing substituted azetidinones | MERCK & CO., INC. (US) | 1998-09-15 | — | — | US | disclosed |
| EP-0858460-A1 | PROCESS FOR PREPARING SUBSTITUTED AZETIDINONES | Merck & Co., Inc. (US) | 1998-08-19 | — | — | EP | disclosed |
| WO-1997016448-A1 | PROCESS FOR PREPARING SUBSTITUTED AZETIDINONES | MERCK & CO., INC. (US) | 1997-05-09 | — | — | WO | disclosed |