Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.53 |
| ▸ | TSHR | P16473 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | CA7 | P43166 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.46 |
| ▸ | XDH | P47989 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 5/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL17522159 | 0.87 | ALDH1A1 (0.56) | ALDH1A1TSHRCYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL2332196 | 0.87 | ALDH1A1 (0.49) | ALDH1A1TSHRCYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL838914 | 0.87 | ALDH1A1 (0.53) | ALDH1A1TSHRCYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL4717547 | 0.83 | ALDH1A1 (0.55) | ALDH1A1TSHRCYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL30231055 | 0.82 | ALDH1A1 (0.54) | ALDH1A1TSHRCYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL10043657 | 0.82 | ALDH1A1 (0.50) | ALDH1A1TSHRCYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL694449 | 0.82 | ALDH1A1 (0.54) | ALDH1A1TSHRCYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL9411180 | 0.81 | PKM (0.47) | ALDH1A1TSHRMAPTL3MBTL1HTT | |
| SCHEMBL1246048 | 0.81 | TSHR (0.59) | ALDH1A1TSHRSMN1; SMN2CA2MAPT | |
| SCHEMBL29128071 | 0.81 | NPC1 (0.56) | ALDH1A1TSHRCYP1A2CYP2C19SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2006079857-A1 | DIARYL ACETIC ACID DERIVATIVES AND THE PREPARATION THEREOF | SANOFI-AVENTIS (FR) | 2006-08-03 | — | — | WO | disclosed |