Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 5/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | XBP1 | P17861 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10189424 | 1.00 | POLB (0.48) | POLBHSD17B10SIGMAR1KMT2AMEN1 | |
| SCHEMBL10189422 | 1.00 | POLB (0.48) | POLBHSD17B10SIGMAR1KMT2AMEN1 | |
| SCHEMBL621552 | 1.00 | POLB (0.48) | POLBHSD17B10SIGMAR1KMT2AMEN1 | |
| Vaborbactam SCHEMBL18967758 | 0.93 | SIGMAR1 (0.45) | POLBHSD17B10SIGMAR1KMT2AMEN1 | |
| Vaborbactam SCHEMBL22726486 | 0.93 | SIGMAR1 (0.45) | POLBHSD17B10SIGMAR1KMT2AMEN1 | |
| Vaborbactam SCHEMBL620289 | 0.93 | SIGMAR1 (0.45) | POLBHSD17B10SIGMAR1KMT2AMEN1 | |
| Vaborbactam SCHEMBL622398 | 0.93 | SIGMAR1 (0.45) | POLBHSD17B10SIGMAR1KMT2AMEN1 | |
| SCHEMBL10158979 | 0.90 | POLB (0.47) | POLBHSD17B10SIGMAR1KMT2AMEN1 | |
| SCHEMBL10158925 | 0.90 | POLB (0.47) | POLBHSD17B10SIGMAR1KMT2AMEN1 | |
| SCHEMBL20661301 | 0.86 | POLB (0.47) | POLBHSD17B10SIGMAR1KMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3666778-B1 | CYCLIC BORONIC ACID ESTER DERIVATIVES AND THERAPEUTIC USES THEREOF | MELINTA THERAPEUTICS INC (US) | 2021-11-10 | — | — | EP | disclosed |
| EP-3412676-B1 | CYCLIC BORONIC ACID ESTER DERIVATIVES, METHOD FOR THE PREPARATION AND THERAPEUTIC USES THEREOF | REMPEX PHARMACEUTICALS INC (US) | 2020-02-12 | — | — | EP | disclosed |