Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | CTSD | P07339 | 1/20 | 0.46 |
| ▸ | KDM5C | P41229 | 1/20 | 0.46 |
| ▸ | PHF8 | Q9UPP1 | 1/20 | 0.46 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21065998 | 0.83 | GAA (0.59) | KDM4ECTSDKDM5CPHF8KDM2A | |
| SCHEMBL27465281 | 0.79 | KDM4E (0.44) | KDM4ECTSDKDM5CPHF8KDM2A | |
| SCHEMBL4148560 | 0.79 | CTSD (0.50) | KDM4ECTSDKDM5CPHF8KDM2A | |
| SCHEMBL27922560 | 0.79 | KDM4E (0.50) | KDM4ECTSDKDM5CPHF8KDM2A | |
| SCHEMBL4409617 | 0.77 | GAA (0.57) | KDM4ECTSDKDM5CPHF8KDM2A | |
| SCHEMBL6500627 | 0.77 | TSHR (0.40) | KDM4ECTSDGAALMNACYP2C19 | |
| SCHEMBL28984124 | 0.77 | ALOX15 (0.41) | CTSDGAALMNACYP2C19CHRM2 | |
| SCHEMBL7263711 | 0.75 | — | — | |
| SCHEMBL4409987 | 0.75 | GAA (0.55) | KDM4ECTSDKDM5CPHF8KDM2A | |
| SCHEMBL9183915 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-111670187-B | Beta-lactamase inhibitor and use thereof | 苏州信诺维医药科技有限公司 | 2021-04-16 | — | — | CN | disclosed |
| CN-111670187-A | Beta-lactamase inhibitor and use thereof | 苏州信诺维医药科技有限公司 | 2020-09-15 | — | — | CN | disclosed |