Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.66 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.66 |
| ▸ | NPC1 | O15118 | 2/20 | 0.63 |
| ▸ | RAB9A | P51151 | 1/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | HTR2C | P28335 | 1/20 | 0.51 |
| ▸ | HTR7 | P34969 | 1/20 | 0.51 |
| ▸ | MAOA | P21397 | 3/20 | 0.49 |
| ▸ | MAOB | P27338 | 3/20 | 0.49 |
| ▸ | APP | P05067 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | CNR1 | P21554 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL30232690 | 1.00 | TAS1R3 (0.66) | TAS1R3TAS1R1NPC1RAB9AALDH1A1 | |
| SCHEMBL4842263 | 0.83 | MAOA (0.71) | TAS1R3TAS1R1NPC1RAB9AALDH1A1 | |
| SCHEMBL12994650 | 0.83 | NPC1 (0.68) | NPC1RAB9AALDH1A1SMN1; SMN2CYP1A2 | |
| SCHEMBL31705591 | 0.82 | CYP1A2 (0.68) | NPC1RAB9AALDH1A1SMN1; SMN2CYP1A2 | |
| SCHEMBL3826771 | 0.82 | CYP1A2 (0.68) | NPC1RAB9AALDH1A1SMN1; SMN2CYP1A2 | |
| Hydrochloric Acid SCHEMBL4843995 | 0.81 | MAOA (0.69) | TAS1R3TAS1R1NPC1RAB9AALDH1A1 | |
| SCHEMBL6788390 | 0.81 | TAS1R3 (0.61) | TAS1R3TAS1R1NPC1RAB9AALDH1A1 | |
| SCHEMBL20662825 | 0.81 | TAS1R3 (0.65) | TAS1R3TAS1R1NPC1RAB9AALDH1A1 | |
| Hydrochloric Acid SCHEMBL31202578 | 0.80 | NPC1 (0.69) | NPC1RAB9AALDH1A1SMN1; SMN2CYP1A2 | |
| SCHEMBL702289 | 0.80 | TAS1R3 (1.00) | TAS1R3TAS1R1NPC1RAB9AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3431464-A2 | NOVEL FLAVORS, FLAVOR MODIFIERS, TASTANTS, TASTE ENHANCERS, UMAMI OR SWEET TASTANTS, AND/OR ENHANCERS AND USE THEREOF | Senomyx Inc. (US) | 2019-01-23 | — | — | EP | disclosed |