Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 9/20 | 0.40 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | PSMB1 | P20618 | 4/20 | 0.36 |
| ▸ | PSMB5 | P28074 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20786912 | 0.85 | HSD17B10 (0.42) | TNFGRM2HTR2AHTR2CPSMB1 | |
| SCHEMBL20786954 | 0.79 | PSMB1 (0.41) | TNFGRM2HTR2AHTR2CPSMB1 | |
| SCHEMBL20809183 | 0.79 | TNF (0.37) | TNFGRM2HTR2AHTR2CPSMB1 | |
| SCHEMBL6923560 | 0.78 | GRM2 (0.55) | TNFGRM2HTR2AHTR2CPSMB1 | |
| SCHEMBL20786928 | 0.76 | HDAC3 (0.47) | TNFGRM2HTR2AHTR2CPSMB1 | |
| SCHEMBL20808710 | 0.76 | PSMB1 (0.41) | TNFGRM2HTR2AHTR2CPSMB1 | |
| SCHEMBL20809182 | 0.76 | PSMB1 (0.41) | TNFGRM2HTR2AHTR2CPSMB1 | |
| SCHEMBL1500208 | 0.75 | PSMB1 (0.43) | TNFGRM2HTR2AHTR2CPSMB1 | |
| SCHEMBL22445638 | 0.75 | MAPT (0.35) | TNFGRM2HTR2AHTR2CPSMB1 | |
| SCHEMBL20786935 | 0.75 | GRM2 (0.41) | TNFGRM2HTR2AHTR2CPSMB1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3453707-A1 | BENZAZEPINE DERIVATIVE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF | Shanghai de Novo Pharmatech Co., Ltd. (CN) | 2019-03-13 | — | — | EP | disclosed |