Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.44 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.44 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 2/20 | 0.42 |
| ▸ | HTR2C | P28335 | 2/20 | 0.42 |
| ▸ | HTR2B | P41595 | 2/20 | 0.42 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.39 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.39 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.39 |
| ▸ | ADCYAP1R1 | P41586 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | CETP | P11597 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12876072 | 1.00 | TAS1R3 (0.44) | TAS1R3TAS1R1TAS1R2FFAR1HTR2A | |
| SCHEMBL25004988 | 0.81 | ALOX5 (0.45) | TAS1R3TAS1R1TAS1R2FFAR1HTR2A | |
| SCHEMBL23858281 | 0.80 | SSTR1 (0.47) | TAS1R3TAS1R1TAS1R2FFAR1HTR2C | |
| SCHEMBL23858279 | 0.80 | SSTR1 (0.47) | TAS1R3TAS1R1TAS1R2FFAR1HTR2C | |
| SCHEMBL23858278 | 0.80 | SSTR1 (0.47) | TAS1R3TAS1R1TAS1R2FFAR1HTR2C | |
| SCHEMBL30075780 | 0.80 | SSTR1 (0.47) | TAS1R3TAS1R1TAS1R2FFAR1HTR2C | |
| SCHEMBL12875677 | 0.79 | KDM1A (0.47) | KDM1AEPHX2CYP2D6CYP2C19 | |
| SCHEMBL18998726 | 0.79 | KDM1A (0.47) | KDM1AEPHX2CYP2D6CYP2C19 | |
| SCHEMBL18998470 | 0.79 | KDM1A (0.47) | KDM1AEPHX2CYP2D6CYP2C19 | |
| SCHEMBL8333649 | 0.79 | HTR2C (0.63) | HTR2AHTR2CHTR2BKDM1ASLC9A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021222522-A1 | CD73 INHIBITING 2,4-DIOXOPYRIMIDINE COMPOUNDS | GILEAD SCIENCES, INC. (US) | 2021-11-04 | — | — | WO | disclosed |