Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.35 |
| ▸ | AXL | P30530 | 1/20 | 0.35 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 4/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.34 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.33 |
| ▸ | ACP1 | P24666 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL25722706 | 0.87 | TDP1 (0.40) | CYP1A2TDP1CYP3A4ALOX15TSHR | |
| SCHEMBL25491239 | 0.81 | GABRA1 (0.52) | GABRA1GABRB2CYP1A2TDP1TSHR | |
| SCHEMBL25005922 | 0.79 | HSD11B1 (0.38) | CYP1A2TDP1CYP3A4ALOX15TSHR | |
| SCHEMBL24497694 | 0.78 | PTK2 (0.46) | CYP1A2TDP1CYP3A4TSHRAXL | |
| SCHEMBL22662731 | 0.78 | CYP1A2 (0.35) | CYP1A2TDP1CYP3A4ALOX15TSHR | |
| SCHEMBL22662730 | 0.78 | TSHR (0.35) | CYP1A2TDP1CYP3A4ALOX15TSHR | |
| SCHEMBL1107763 | 0.77 | CYP2A6 (0.45) | CYP1A2TDP1ALOX15TSHRHSD17B10 | |
| SCHEMBL24655960 | 0.75 | AR (0.41) | CYP3A4ALOX15TSHRMAPK1HSD17B10 | |
| SCHEMBL19130451 | 0.75 | P2RX7 (0.46) | GABRA1GABRB2CYP1A2TDP1CYP3A4 | |
| Hydrochloric Acid SCHEMBL2857487 | 0.74 | CYP2A6 (0.43) | CYP1A2TDP1CYP3A4ALOX15TSHR |
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-2018118947-A1 | THIENOPYRROLE DERIVATIVES FOR USE IN TARGETING PROTEINS, COMPOSITIONS, METHODS, AND USES THEREOF | BIOTHERYX, INC. (US) | 2018-06-28 | — | — | WO | disclosed |