Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.49 |
| ▸ | KDM1A | O60341 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | HTR3A | P46098 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.39 |
| ▸ | HTR2A | P28223 | 2/20 | 0.39 |
| ▸ | HTR2C | P28335 | 2/20 | 0.39 |
| ▸ | HTR4 | Q13639 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL7363375 | 0.79 | CHRNA7 (0.50) | CHRNB2CHRNB4CHRNA3CHRNA7CHRNA4 | |
| SCHEMBL7334925 | 0.73 | KDM1A (0.47) | KDM1AHTR3AHTR4 | |
| SCHEMBL8888452 | 0.72 | ACHE (0.52) | — | |
| SCHEMBL26513551 | 0.72 | KDM1A (0.46) | KDM1A | |
| SCHEMBL8890240 | 0.70 | DRD4 (0.51) | — | |
| SCHEMBL8889800 | 0.69 | MCHR1 (0.48) | SIGMAR1FAAH | |
| SCHEMBL5432144 | 0.69 | SIGMAR1 (0.65) | SIGMAR1GAACHRNA7HTR3A | |
| SCHEMBL6347383 | 0.69 | CHRM2 (0.49) | CHRNA7CHRM2CHRM1CHRM3CHRM4 | |
| SCHEMBL8888782 | 0.68 | MCHR1 (0.58) | SIGMAR1 | |
| SCHEMBL9123192 | 0.68 | KDM1A (0.40) | KDM1ACYP2D6FAAH |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0385722-B1 | Tricyclic lactam derivatives and pharmaceutical compositions containing them | GLAXO GROUP LTD (GB) | 1995-04-19 | — | — | EP | disclosed |
| US-5013733-A | Psychological disorders, antianxiety, 5-hydroxytryptamine antagonists | GLAXO GROUP LIMITED (GB) | 1991-05-07 | — | — | US | disclosed |
| EP-0385722-A2 | Tricyclic lactam derivatives and pharmaceutical compositions containing them | GLAXO GROUP LIMITED (GB) | 1990-09-05 | — | — | EP | disclosed |