Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | BPTF | Q12830 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | ADAMTS5 | Q9UNA0 | 2/20 | 0.32 |
| ▸ | MMP13 | P45452 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.32 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | RAF1 | P04049 | 1/20 | 0.31 |
| ▸ | BRAF | P15056 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL24253711 | 1.00 | TSHR (0.39) | TSHRBPTFHSD11B1ADAMTS5MMP13 | |
| Hydrochloric Acid SCHEMBL30494641 | 0.99 | TSHR (0.38) | TSHRBPTFHSD11B1ADAMTS5MMP13 | |
| SCHEMBL26307736 | 0.90 | CCR1 (0.33) | TSHRADAMTS5ROCK2 | |
| SCHEMBL24253590 | 0.90 | MMP2 (0.33) | ADAMTS5MMP13CYP11B2 | |
| SCHEMBL24253912 | 0.86 | BPTF (0.37) | TSHRBPTFADAMTS5MMP13HTR1A | |
| SCHEMBL24253768 | 0.80 | HSD11B1 (0.34) | TSHRBPTFHSD11B1ADAMTS5MMP13 | |
| SCHEMBL30494563 | 0.77 | ADAMTS5 (0.41) | ADAMTS5MMP13ROCK2 | |
| SCHEMBL24253710 | 0.77 | HTR1A (0.36) | TSHRBPTFMMP13HTR1ADRD2 | |
| SCHEMBL24253592 | 0.76 | CYP11B2 (0.33) | ADAMTS5CYP11B2 | |
| SCHEMBL26307735 | 0.76 | MAPT (0.33) | ADAMTS5ROCK2 |
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-116157404-A | Heteroaryl substituted spiropiperidinyl derivatives and pharmaceutical uses thereof | 诺华股份有限公司 | 2023-05-23 | — | — | CN | disclosed |