Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 4/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | MCHR2 | Q969V1 | 1/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.35 |
| ▸ | HTR1B | P28222 | 2/20 | 0.34 |
| ▸ | CHRNA1 | P02708 | 2/20 | 0.34 |
| ▸ | CHRNG | P07510 | 2/20 | 0.34 |
| ▸ | CHRNB1 | P11230 | 2/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.34 |
| ▸ | CHRNA7 | P36544 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2773779 | 0.87 | DRD2 (0.40) | HTR1ACYP2D6SLC6A4ROCK2ESR1 | |
| SCHEMBL2774034 | 0.84 | HTR1A (0.40) | HRH3CA2CA12HTR1ACYP2D6 | |
| SCHEMBL2774320 | 0.79 | HRH3 (0.54) | HRH3HTR1ACYP2D6SLC6A4ROCK2 | |
| SCHEMBL6796403 | 0.78 | ADRA1D (0.47) | HRH3HTR1ASLC6A4MCHR1 | |
| SCHEMBL2775113 | 0.77 | HTR1A (0.42) | HRH3HTR1ACYP2D6SLC6A4ROCK2 | |
| SCHEMBL6796681 | 0.77 | L3MBTL1 (0.49) | HRH3HTR1ASLC6A4KCNH2 | |
| SCHEMBL2776295 | 0.77 | HTR1A (0.38) | HRH3CA12HTR1ACYP2D6SLC6A4 | |
| SCHEMBL2774544 | 0.76 | HTR2A (0.43) | CA2CA12HTR1ACYP2D6SLC6A4 | |
| SCHEMBL6802876 | 0.76 | SIGMAR1 (0.55) | HRH3HTR1ASLC6A4KCNH2 | |
| SCHEMBL2776390 | 0.76 | SLC6A4 (0.54) | HRH3HTR1ACYP2D6SLC6A4CHRM4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010112488-A1 | METHOD FOR OBTAINING 1,3-DIFUNCTIONALIZED PYRROLIDINE DERIVATIVES | RAGACTIVES, S.L.U. (ES) | 2010-10-07 | — | — | WO | disclosed |
| EP-2236509-A1 | Method for obtaining 1,3-difunctionalized pyrrolidine derivatives | Ragactives, S.L. (ES) | 2010-10-06 | — | — | EP | disclosed |