Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.43 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 9/20 | 0.42 |
| ▸ | HTR2B | P41595 | 7/20 | 0.42 |
| ▸ | HTR2A | P28223 | 7/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 1/20 | 0.42 |
| ▸ | HTR3A | P46098 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.38 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8654057 | 1.00 | SIRT2 (0.43) | SIRT2SIRT1HTR2CHTR2BHTR2A | |
| SCHEMBL7136400 | 1.00 | SIRT2 (0.43) | SIRT2SIRT1HTR2CHTR2BHTR2A | |
| SCHEMBL12029844 | 0.86 | MAPK1 (0.40) | SIRT2SIRT1HTR2CHTR2AKCNH2 | |
| SCHEMBL6217518 | 0.86 | MAPK1 (0.40) | SIRT2SIRT1HTR2CHTR2AKCNH2 | |
| SCHEMBL905993 | 0.86 | MAPK1 (0.40) | SIRT2SIRT1HTR2CHTR2AKCNH2 | |
| SCHEMBL7141991 | 0.81 | HTR2A (0.44) | HTR2CHTR2BHTR2AKCNH2HTR1A | |
| SCHEMBL11834071 | 0.81 | HTR2C (0.42) | HTR2CHTR2BHTR2ACHRNB2CHRNA4 | |
| SCHEMBL7141988 | 0.81 | HTR2A (0.44) | HTR2CHTR2BHTR2AKCNH2HTR1A | |
| SCHEMBL6218202 | 0.81 | HTR2B (0.42) | HTR2CHTR2BHTR2ASLC6A4 | |
| SCHEMBL29400162 | 0.81 | HTR2C (0.42) | HTR2CHTR2BHTR2ACHRNB2CHRNA4 |
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-0902684-B1 | HEXAHYDRO-PYRIDO(4,3-B)INDOLE DERIVATIVES AS ANTIPSYCHOTIC DRUGS | JANSSEN PHARMACEUTICA NV (BE) | 2003-04-09 | — | — | EP | disclosed |
| US-6057325-A | HAVE CENTRAL DOPAMINE AND SEROTONIN ANTOGONISTIC ACTIVITY | JANSSEN PHARMACEUTIA, N.V. (BE) | 2000-05-02 | — | — | US | disclosed |