Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | SLC6A2 | P23975 | 9/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.45 |
| ▸ | HTR6 | P50406 | 2/20 | 0.43 |
| ▸ | HTR1A | P08908 | 4/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 2/20 | 0.41 |
| ▸ | HTR1D | P28221 | 1/20 | 0.41 |
| ▸ | HTR1B | P28222 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Fluorobenzene SCHEMBL27488633 | 0.87 | SIGMAR1 (0.52) | KDM4ESLC6A2SLC6A4SIGMAR1HTR7 | |
| Tert-Butyl Formate SCHEMBL28022652 | 0.85 | KDM4E (0.40) | KDM4ESLC6A2SLC6A4SLC6A3KCNH2 | |
| Methylpiperazine SCHEMBL28021853 | 0.79 | HTR1A (0.45) | SLC6A2SLC6A4SLC6A3KCNH2HTR6 | |
| Methylpiperazine SCHEMBL28021851 | 0.78 | HTR1A (0.44) | SLC6A2SLC6A4SLC6A3KCNH2HTR6 | |
| SCHEMBL29566534 | 0.77 | ALDH1A1 (0.70) | KDM4ESIGMAR1CHRM3ALDH1A1SMN1; SMN2 | |
| SCHEMBL608181 | 0.77 | ALDH1A1 (0.70) | KDM4ESIGMAR1CHRM3ALDH1A1SMN1; SMN2 | |
| SCHEMBL1307906 | 0.77 | HRH3 (0.46) | SIGMAR1ALDH1A1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL2924548 | 0.76 | ALDH1A1 (0.68) | KDM4ESIGMAR1CHRM3ALDH1A1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL7426019 | 0.76 | ALDH1A1 (0.68) | KDM4ESIGMAR1CHRM3ALDH1A1SMN1; SMN2 | |
| SCHEMBL5943 | 0.76 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102838546-B | Pyrazole derivatives as modulators of 5-ht2a serotonin receptor useful for treatment of disorders related thereto | ARENA PHARM INC | 2015-07-15 | — | — | CN | disclosed |
| CN-102838546-A | Pyrazole derivatives as modulators of 5-ht2a serotonin receptor useful for treatment of disorders related thereto | ARENA PHARM INC | 2012-12-26 | — | — | CN | disclosed |
| CN-101611013-B | As 5-HT2APyrazole derivatives of serotonin receptor modulators for the treatment of disorders related thereto | ARENA PHARM INC | 2012-09-05 | — | — | CN | disclosed |
| CN-101611013-A | As 5-HT2APyrazole derivatives of serotonin receptor modulators for the treatment of disorders related thereto | ARENA PHARM INC (US) | 2009-12-23 | — | — | CN | disclosed |