Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 9/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | PGR | P06401 | 1/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | AR | P10275 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.44 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5425825 | 0.86 | LMNA (0.42) | CYP2C9HSD17B10LMNACYP1A2ADORA3 | |
| SCHEMBL28542544 | 0.84 | PTGS2 (0.45) | CYP2C9HSD17B10LMNACYP1A2MAPT | |
| SCHEMBL23646603 | 0.80 | HSD17B10 (0.49) | CYP2C9HSD17B10BLMESR1LMNA | |
| SCHEMBL1811461 | 0.79 | CYP1A2 (0.39) | CYP2C9HSD17B10BLMLMNACYP3A4 | |
| Hydrochloric Acid SCHEMBL9560519 | 0.79 | ESR1 (0.50) | CYP2C9HSD17B10ESR1LMNACYP3A4 | |
| SCHEMBL1809439 | 0.78 | ALDH1A1 (0.39) | CYP2C9HSD17B10LMNACYP2C19ALDH1A1 | |
| SCHEMBL22074723 | 0.77 | BLM (0.47) | CYP2C9HSD17B10BLMESR1LMNA | |
| SCHEMBL22074727 | 0.77 | BLM (0.47) | CYP2C9HSD17B10BLMESR1LMNA | |
| SCHEMBL25597560 | 0.77 | BLM (0.47) | CYP2C9HSD17B10BLMESR1LMNA | |
| SCHEMBL606178 | 0.77 | ACHE (0.50) | CYP2C9HSD17B10LMNACYP2C19ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112236161-A | Modulators of G protein-coupled receptors | 卡莫特治疗学股份有限公司 | 2021-01-15 | — | — | CN | disclosed |