Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.33 |
| ▸ | DRD3 | P35462 | 3/20 | 0.33 |
| ▸ | DRD2 | P14416 | 2/20 | 0.33 |
| ▸ | DRD4 | P21917 | 2/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6512880 | 0.91 | LMNA (0.39) | CYP2C19HIF1AMAPTKMT2ASMN1; SMN2 | |
| SCHEMBL6514478 | 0.81 | LMNA (0.38) | CYP2C19HIF1AMAPTKMT2ASMN1; SMN2 | |
| SCHEMBL6508451 | 0.81 | LMNA (0.38) | CYP2C19HIF1AMAPTKMT2ASMN1; SMN2 | |
| SCHEMBL6515224 | 0.80 | SIGMAR1 (0.38) | CYP2C19HIF1AMAPTKMT2ASMN1; SMN2 | |
| SCHEMBL9513410 | 0.74 | CYP2C19 (0.50) | CYP2C19HIF1AMAPTKMT2ASMN1; SMN2 | |
| SCHEMBL6448291 | 0.74 | CYP2C19 (0.41) | CYP2C19HIF1AMAPTKMT2ALMNA | |
| SCHEMBL245863 | 0.73 | CYP2C19 (0.58) | CYP2C19HIF1AMAPTKMT2AALDH1A1 | |
| SCHEMBL7041512 | 0.72 | CYP2C19 (0.48) | CYP2C19HIF1AMAPTKMT2ASMN1; SMN2 | |
| SCHEMBL6387762 | 0.71 | KIF11 (0.55) | CYP2C19HIF1AMAPTKMT2ASMN1; SMN2 | |
| SCHEMBL6391556 | 0.71 | ALOX12 (0.46) | CYP2C19HIF1AMAPTKMT2ASMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005068420-A1 | UREA AND THIOUREA COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES | ESPERION THERAPEUTICS, INC. (US) | 2005-07-28 | — | — | WO | claimed |
| WO-2005068420-A1 | UREA AND THIOUREA COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES | ESPERION THERAPEUTICS, INC. (US) | 2005-07-28 | — | — | WO | disclosed |