Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.55 |
| ▸ | TSHR | P16473 | 4/20 | 0.55 |
| ▸ | ESR1 | P03372 | 2/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.55 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.55 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.55 |
| ▸ | KDR | P35968 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 7/20 | 0.53 |
| ▸ | HPGD | P15428 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.49 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | DRD3 | P35462 | 2/20 | 0.48 |
| ▸ | SCN1A | P35498 | 2/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL58345 | 0.88 | CA12 (0.53) | ALDH1A1TSHRESR1TDP1LMNA | |
| SCHEMBL8119057 | 0.84 | CA12 (0.51) | ALDH1A1TSHRESR1TDP1LMNA | |
| SCHEMBL23961165 | 0.83 | CA12 (0.47) | ALDH1A1TSHRESR1LMNAHPGD | |
| SCHEMBL148292 | 0.83 | ALDH1A1 (0.64) | ALDH1A1TSHRESR1TDP1CHRM1 | |
| SCHEMBL7151637 | 0.82 | LMNA (0.50) | ALDH1A1TSHRESR1LMNAHPGD | |
| SCHEMBL23663774 | 0.81 | LMNA (0.64) | ALDH1A1TSHRESR1TDP1CHRM1 | |
| SCHEMBL8651067 | 0.81 | ALDH1A1 (0.57) | ALDH1A1TSHRESR1TDP1CHRM1 | |
| SCHEMBL7147366 | 0.80 | LMNA (0.50) | ALDH1A1TSHRESR1LMNAHPGD | |
| SCHEMBL8602388 | 0.80 | ESR1 (0.54) | ALDH1A1TSHRESR1LMNAHPGD | |
| SCHEMBL15779709 | 0.80 | PHLPP2 (0.45) | ALDH1A1TSHRESR1TDP1CHRM1 |
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-6620864-B2 | With a plasticizer, a catalyst for hardening by ring opening, a catalyst for hardening by light and as accelerator a p-aminobenzoic acid alkyl ester, N,N-disubstituted by hydroxyalkyl groups; free of contraction and adhesiveness | LSP DENTAL CHEMISTRY AG (CH) | 2003-09-16 | — | — | US | disclosed |
| US-20020040103-A1 | Epoxy compounds for use in dental medicine and/or dentistry | LSP DENTAL CHEMISTRY AG (CH) | 2002-04-04 | — | — | US | disclosed |