Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.49 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.47 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.47 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.47 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.47 |
| ▸ | KDM4C | Q9H3R0 | 3/20 | 0.47 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 1/20 | 0.45 |
| ▸ | HTR7 | P34969 | 1/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.44 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.43 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10823071 | 1.00 | ESR1 (0.49) | ESR1TAS1R3TAS1R1TAS1R2CHRNA7 | |
| SCHEMBL3823105 | 1.00 | ESR1 (0.49) | ESR1TAS1R3TAS1R1TAS1R2CHRNA7 | |
| SCHEMBL12070481 | 0.82 | CHRM4 (0.44) | KDM4CCHRM4DRD2HTR7MEN1 | |
| SCHEMBL2740684 | 0.81 | TAS1R3 (0.44) | TAS1R3TAS1R1TAS1R2KDM4CMTNR1B | |
| SCHEMBL2740675 | 0.81 | TAS1R3 (0.44) | TAS1R3TAS1R1TAS1R2KDM4CMTNR1A | |
| SCHEMBL9523155 | 0.80 | TAS1R3 (0.49) | TAS1R3TAS1R1TAS1R2CHRNA7KDM4C | |
| SCHEMBL345441 | 0.79 | CHRNA7 (0.50) | TAS1R3TAS1R1TAS1R2CHRNA7CYP19A1 | |
| SCHEMBL9520921 | 0.79 | CHRNA7 (0.45) | TAS1R3TAS1R1TAS1R2CHRNA7 | |
| SCHEMBL6808225 | 0.78 | LRRK2 (0.49) | KDM4CCHRM4DRD2HTR7 | |
| SCHEMBL17754016 | 0.78 | HTR6 (0.47) | TAS1R3TAS1R1TAS1R2KDM4C |
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-1846379-B1 | ANTIDIABETIC BICYCLIC COMPOUNDS | MERCK & CO INC (US) | 2009-08-19 | — | — | EP | disclosed |