Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9825263 | 0.86 | L3MBTL1 (0.47) | CYP1A2MAPK1SMN1; SMN2SIGMAR1HRH3 | |
| SCHEMBL9824090 | 0.81 | L3MBTL1 (0.46) | CYP1A2MAPK1SMN1; SMN2SIGMAR1HRH3 | |
| SCHEMBL8053644 | 0.80 | HRH3 (0.50) | CYP1A2MAPK1SMN1; SMN2HRH3ACHE | |
| SCHEMBL24754066 | 0.78 | MAPT (0.47) | CYP1A2HRH3POLBMAPTCHRM1 | |
| SCHEMBL6069474 | 0.77 | PKM (0.47) | POLBMAPTCHRM1CHRM2CHRM4 | |
| SCHEMBL30115021 | 0.77 | HRH3 (0.54) | CYP1A2SIGMAR1HRH3CHRM5 | |
| SCHEMBL30115019 | 0.77 | HRH3 (0.54) | CYP1A2SIGMAR1HRH3CHRM5 | |
| SCHEMBL15150 | 0.76 | GAA (0.58) | CYP1A2MAPK1SMN1; SMN2GAAALDH1A1 | |
| SCHEMBL10942934 | 0.76 | GAA (0.58) | CYP1A2MAPK1SMN1; SMN2GAAALDH1A1 | |
| SCHEMBL9174370 | 0.76 | GAA (0.58) | CYP1A2MAPK1SMN1; SMN2GAAALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5175158-A | CONDENSED DIAZEPINONES, PROCESSES FOR PREPARING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS | DR. KARL THOMAE, GMBH (DE) | 1992-12-29 | — | — | US | disclosed |