Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 6/20 | 0.39 |
| ▸ | HTR2A | P28223 | 6/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | SRC | P12931 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.32 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | MTOR | P42345 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | GRM7 | Q14831 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6681384 | 0.78 | POLB (0.45) | HRH1HTR2ASIGMAR1LMNA | |
| SCHEMBL5610591 | 0.78 | HRH1 (0.44) | HRH1HTR2ATAAR1SIGMAR1 | |
| SCHEMBL10846548 | 0.78 | TRPA1 (0.41) | HRH1HTR2ATAAR1CYP2D6LMNA | |
| SCHEMBL16426377 | 0.78 | HTR2A (0.39) | HRH1HTR2ATAAR1SIGMAR1MTOR | |
| SCHEMBL4890470 | 0.78 | HRH1 (0.39) | HRH1HTR2ATAAR1SIGMAR1MTOR | |
| SCHEMBL16645107 | 0.77 | HRH1 (0.39) | HRH1HTR2ATAAR1MTORRAB9A | |
| SCHEMBL28973809 | 0.77 | HRH1 (0.38) | HRH1HTR2ATAAR1CYP2D6SIGMAR1 | |
| SCHEMBL6682968 | 0.77 | SIGMAR1 (0.44) | HRH1HTR2ASIGMAR1LMNA | |
| SCHEMBL28918758 | 0.77 | HRH1 (0.42) | HRH1HTR2ATAAR1SIGMAR1 | |
| SCHEMBL7319044 | 0.76 | TBXAS1 (0.53) | CYP2D6LMNAMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103827090-B | Substituted quinolines and their use as pharmaceuticals | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2016-04-20 | — | — | CN | disclosed |