Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | ACACB | O00763 | 7/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | MMP1 | P03956 | 2/20 | 0.33 |
| ▸ | MMP2 | P08253 | 2/20 | 0.33 |
| ▸ | MMP3 | P08254 | 2/20 | 0.33 |
| ▸ | MMP9 | P14780 | 1/20 | 0.33 |
| ▸ | MMP13 | P45452 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ACACA | Q13085 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16367683 | 0.85 | TSHR (0.40) | ACACBTSHRMMP1MMP2MMP3 | |
| SCHEMBL8972302 | 0.85 | TSHR (0.40) | ACACBTSHRMMP1MMP2MMP3 | |
| SCHEMBL8972192 | 0.82 | CYP2D6 (0.50) | CYP2D6CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL5808284 | 0.82 | TSHR (0.41) | LMNAACACBTSHRACACA | |
| SCHEMBL8972157 | 0.78 | MGAM (0.46) | ACACBTSHRCYP2D6 | |
| SCHEMBL8971704 | 0.77 | CYP2D6 (0.53) | CYP2D6 | |
| SCHEMBL2805934 | 0.77 | ACACB (0.36) | LMNAACACBMAPT | |
| SCHEMBL754155 | 0.77 | ACACB (0.36) | LMNAACACBMAPT | |
| SCHEMBL7486707 | 0.72 | LMNA (0.37) | LMNATSHRMMP1MMP2MMP3 | |
| SCHEMBL7486702 | 0.72 | LMNA (0.37) | LMNATSHRMMP1MMP2MMP3 |
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 |
|---|---|---|---|---|---|---|---|
| US-5518903-A | HYDROLYSIS OF ESTER | CHISSO CORPORATION (JP) | 1996-05-21 | — | — | US | disclosed |