Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 2/20 | 0.42 |
| ▸ | IDO1 | P14902 | 4/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 3/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | APP | P05067 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18242800 | 0.80 | CACNA1H (0.35) | IDO1CES2PTPN5CYP3A4TSHR | |
| SCHEMBL10310070 | 0.77 | CYP2D6 (0.36) | PDE2AIDO1GAATRPA1AKR1C3 | |
| SCHEMBL21457919 | 0.76 | IDO1 (0.40) | IDO1CES2PTPN5CYP3A4TSHR | |
| SCHEMBL18242209 | 0.75 | ERN1 (0.33) | CES2 | |
| SCHEMBL28117463 | 0.75 | PDE2A (0.49) | PDE2AIDO1GAA | |
| SCHEMBL9341736 | 0.74 | CYP2D6 (0.39) | PDE2AIDO1GAACES2CYP3A4 | |
| SCHEMBL15157741 | 0.72 | CES2 (0.38) | PDE2AIDO1GAACES2APP | |
| SCHEMBL16327958 | 0.70 | PDE2A (0.41) | PDE2AIDO1GAACES2TSHR | |
| SCHEMBL23571233 | 0.70 | PDE2A (0.40) | PDE2AIDO1TRPA1AKR1C3AKR1C2 | |
| SCHEMBL2005442 | 0.69 | CES2 (0.40) | PDE2AIDO1CES2PTPN5CYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104169281-B | The pyrroles's diformamide condensed and they are as the purposes of medicine | 赛诺菲 | 2016-12-14 | — | — | CN | claimed |
| CN-104169281-B | The pyrroles's diformamide condensed and they are as the purposes of medicine | 赛诺菲 | 2016-12-14 | — | — | CN | disclosed |