Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.33 |
| ▸ | CFTR | P13569 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | DHFR | P00374 | 2/20 | 0.32 |
| ▸ | DCPS | Q96C86 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28762361 | 0.85 | CD44 (0.38) | ALDH1A1TDP1ADRA2BPTGS1CYP1A2 | |
| SCHEMBL28382868 | 0.82 | ALDH1A1 (0.38) | ALDH1A1TDP1ADRA2BPTGS1CYP1A2 | |
| SCHEMBL27412041 | 0.78 | CA1 (0.48) | ALDH1A1TDP1ADRA2BPTGS1CYP1A2 | |
| SCHEMBL27411561 | 0.78 | CA1 (0.48) | ALDH1A1TDP1ADRA2BPTGS1CYP1A2 | |
| SCHEMBL7868990 | 0.77 | TAAR1 (0.52) | ALDH1A1TDP1ADRA2BPTGS1TSHR | |
| SCHEMBL111291 | 0.77 | TSHR (0.59) | ALDH1A1TDP1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL3820403 | 0.77 | TSHR (0.59) | ALDH1A1TDP1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL22969912 | 0.76 | ADRB2 (0.43) | ALDH1A1CYP1A2TSHRCYP3A4CASP1 | |
| SCHEMBL2118316 | 0.76 | TSHR (0.35) | ALDH1A1CYP1A2CYP2C9CYP2C19TSHR | |
| SCHEMBL25986475 | 0.75 | ALDH1A1 (0.37) | ALDH1A1CYP1A2CYP2C9CYP2C19TSHR |
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-2023158802-A1 | COMPOUNDS AND RADIOLIGANDS FOR TARGETING NEUROTENSIN RECEPTOR AND USES THEREOF | FULL-LIFE TECHNOLOGIES U.S. INC. (US) | 2023-08-24 | — | — | WO | disclosed |