Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 3/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL10792127 | 0.85 | FAAH (0.37) | NPSR1MEN1KMT2ACYP3A4CYP2D6 | |
| SCHEMBL452622 | 0.83 | HCAR2 (0.41) | CHRM2CHRM1CHRM3ALDH1A1LMNA | |
| SCHEMBL9065697 | 0.80 | MEN1 (0.32) | CHRM2CHRM1CHRM3MEN1KMT2A | |
| SCHEMBL9065316 | 0.80 | MEN1 (0.32) | CHRM2CHRM1CHRM3MEN1KMT2A | |
| SCHEMBL1748129 | 0.80 | TSHR (0.36) | CHRM2CHRM1CHRM3ALDH1A1MEN1 | |
| SCHEMBL455718 | 0.80 | ALDH1A1 (0.48) | ALDH1A1LMNACYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL456197 | 0.79 | MEN1 (0.48) | ALDH1A1LMNACYP1A2CYP2C9CYP2C19 | |
| SCHEMBL11034348 | 0.78 | NAAA (0.47) | ALDH1A1LMNANPSR1CYP3A4TSHR | |
| SCHEMBL6064962 | 0.78 | ALDH1A1 (0.35) | CHRM2CHRM1CHRM3ALDH1A1LMNA | |
| SCHEMBL9472810 | 0.77 | NAAA (0.50) | ALDH1A1LMNANPSR1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5569780-A | Dialkyl 2-haloethyl malonates | HULS AKTIENGESELLSCHAFT (DE) | 1996-10-29 | — | — | US | disclosed |
| US-5463111-A | Process for preparing dialkyl 2-haloethyl malonates | HULS AKTIENGESELLSCHAFT (DE) | 1995-10-31 | — | — | US | disclosed |