Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1 | Q15116 | 1/20 | 0.39 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | PPIA | P62937 | 1/20 | 0.30 |
| ▸ | CYP2A6 | P11509 | 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 | |
|---|---|---|---|---|
| SCHEMBL5034116 | 0.76 | GPR3 (0.34) | HTR2A | |
| SCHEMBL9020786 | 0.76 | ALDH1A1 (0.35) | — | |
| SCHEMBL2230423 | 0.76 | HTR2A (0.42) | PDCD1CD274PDK2APOBEC3GHTR2A | |
| SCHEMBL31274740 | 0.76 | HTR2A (0.42) | PDCD1CD274PDK2APOBEC3GHTR2A | |
| SCHEMBL1044055 | 0.75 | GPR3 (0.41) | HTR2A | |
| SCHEMBL29953549 | 0.75 | GPR3 (0.41) | HTR2A | |
| SCHEMBL18343745 | 0.70 | GPR3 (0.32) | — | |
| SCHEMBL29175309 | 0.69 | HTR2A (0.45) | PDCD1CD274PDK2APOBEC3GHTR2A | |
| SCHEMBL447441 | 0.68 | MEN1 (0.35) | PDK2 | |
| SCHEMBL16632987 | 0.67 | GPR3 (0.41) | HTR2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0669921-A4 | PREPARATION OF 2-ARYL CARBAPENEMS VIA A BORONIC ACID COUPLING REACTION. | MERCK & CO INC (US) | 1996-02-07 | — | — | EP | disclosed |
| EP-0669921-A1 | PREPARATION OF 2-ARYL CARBAPENEMS VIA A BORONIC ACID COUPLING REACTION | MERCK & CO. INC. (US) | 1995-09-06 | — | — | EP | disclosed |
| US-5442057-A | Preparation of 2-aryl carbapenems via a boronic acid coupling reaction | DECAMP ANN (US) | 1995-08-15 | — | — | US | disclosed |
| US-5338875-A | Boron containing intermediates useful in the preparation of carbapenems | MERCK & CO., INC. (US) | 1994-08-16 | — | — | US | disclosed |
| WO-1994011372-A1 | PREPARATION OF 2-ARYL CARBAPENEMS VIA A BORONIC ACID COUPLING REACTION | MERCK & CO., INC. (US) | 1994-05-26 | — | — | WO | disclosed |