Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 4/20 | 0.61 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.61 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.61 |
| ▸ | HTR2B | P41595 | 2/20 | 0.61 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.61 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.61 |
| ▸ | HTR1A | P08908 | 1/20 | 0.61 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.61 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.61 |
| ▸ | HRH1 | P35367 | 1/20 | 0.51 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.51 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.51 |
| ▸ | HTR3A | P46098 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | HTR1D | P28221 | 1/20 | 0.43 |
| ▸ | HTR1B | P28222 | 1/20 | 0.43 |
| ▸ | PIM1 | P11309 | 1/20 | 0.41 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.41 |
| ▸ | IRAK4 | Q9NWZ3 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL134199 | 0.79 | TDP1 (0.55) | HTR2ASLC6A4SLC6A2HTR2BSLC6A3 | |
| SCHEMBL3013228 | 0.78 | POLB (0.43) | CYP1A2 | |
| SCHEMBL2924439 | 0.78 | HTR2A (0.65) | HTR2ASLC6A4SLC6A2HTR2BSLC6A3 | |
| SCHEMBL1002267 | 0.78 | HTR2A (0.65) | HTR2ASLC6A4SLC6A2HTR2BSLC6A3 | |
| SCHEMBL2925939 | 0.78 | HTR2A (0.65) | HTR2ASLC6A4SLC6A2HTR2BSLC6A3 | |
| SCHEMBL5658824 | 0.77 | NPC1 (0.41) | — | |
| SCHEMBL15062036 | 0.77 | SLC6A4 (0.77) | HTR2ASLC6A4SLC6A2HTR2BSLC6A3 | |
| SCHEMBL6161190 | 0.76 | ADRA2C (1.00) | HTR2ASLC6A4SLC6A2HTR2BSLC6A3 | |
| SCHEMBL21254632 | 0.76 | SLC6A4 (0.71) | HTR2ASLC6A4SLC6A2HTR2BSLC6A3 | |
| Viloxazine SCHEMBL34168 | 0.76 | SLC6A4 (1.00) | HTR2ASLC6A4SLC6A2HTR2BSLC6A3 |
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-104470925-A | Imidazotriazinecarbonitriles useful as kinase inhibitors | BRISTOL MYERS SQUIBB CO | 2015-03-25 | — | — | CN | disclosed |