Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 7/20 | 0.38 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.38 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | CCR3 | P51677 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.37 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 2/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4022471 | 0.86 | PTGDR2 (0.39) | PTGDR2PTGER4NLRP3ALDH1A1LMNA | |
| SCHEMBL3664741 | 0.81 | SMN1; SMN2 (0.53) | ALDH1A1LMNAHTTSMN1; SMN2TP53 | |
| SCHEMBL3856745 | 0.77 | PTGER1 (0.49) | HTTSMN1; SMN2TP53NPSR1MAPT | |
| SCHEMBL3940655 | 0.76 | PTGER1 (0.45) | PTGDR2NLRP3ALDH1A1LMNATSHR | |
| SCHEMBL15329333 | 0.76 | PTGDR2 (0.51) | PTGDR2NLRP3SMN1; SMN2MAPT | |
| Hydrochloric Acid SCHEMBL3941965 | 0.75 | PTGER1 (0.45) | PTGDR2NLRP3ALDH1A1LMNATSHR | |
| SCHEMBL2367474 | 0.74 | PTGDR2 (0.48) | PTGDR2NLRP3ALDH1A1LMNATSHR | |
| SCHEMBL13945303 | 0.73 | ESR2 (0.47) | PTGDR2NLRP3TP53NOD1 | |
| SCHEMBL4433374 | 0.73 | GPR52 (0.36) | ALDH1A1LMNAHTTSMN1; SMN2PPARG | |
| SCHEMBL2368280 | 0.72 | GAA (0.48) | PTGDR2NLRP3ALDH1A1LMNATSHR |
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-2009016216-A1 | TRIAZOLE DERIVATIVES AS SCD INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2009-02-05 | — | — | WO | disclosed |