Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.67 |
| ▸ | ANPEP | P15144 | 2/20 | 0.52 |
| ▸ | IDO1 | P14902 | 4/20 | 0.52 |
| ▸ | RET | P07949 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.43 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL113822 | 0.90 | HTR2A (0.73) | HTR2AANPEPIDO1RET | |
| SCHEMBL31165889 | 0.90 | HTR2A (0.73) | HTR2AANPEPIDO1RET | |
| SCHEMBL29586274 | 0.80 | HTR2A (1.00) | HTR2AANPEP | |
| SCHEMBL8247822 | 0.80 | HTR2A (1.00) | HTR2AANPEP | |
| SCHEMBL21847059 | 0.78 | CYP1A2 (0.62) | HTR2AIDO1RETTSHRCYP1A2 | |
| SCHEMBL30837489 | 0.77 | IDO1 (0.58) | HTR2AIDO1RETTSHR | |
| SCHEMBL469047 | 0.77 | IDO1 (0.58) | HTR2AIDO1RETTSHR | |
| SCHEMBL29415502 | 0.77 | IDO1 (0.58) | HTR2AIDO1RETTSHR | |
| SCHEMBL44600 | 0.77 | IDO1 (0.58) | HTR2AIDO1RETTSHR | |
| SCHEMBL10774751 | 0.77 | IDO1 (0.58) | HTR2AIDO1RETTSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-9758515-B2 | Substituted polycyclic carbamoyl pyridone derivative prodrug | SHIONOGI & CO., LTD. (JP) | 2017-09-12 | — | — | US | disclosed |