Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNA2 | P20248 | 1/20 | 0.40 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30812502 | 0.75 | CYP2C19 (0.41) | CYP2C19ALDH1A1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL29148325 | 0.75 | CYP2C19 (0.41) | CYP2C19ALDH1A1SMN1; SMN2KDM4EMAPT | |
| SCHEMBL9454925 | 0.72 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2KDM4EGAAL3MBTL1 | |
| SCHEMBL10712712 | 0.72 | GAA (0.46) | CCNA2CCNE1CDK2CYP2C19ALDH1A1 | |
| SCHEMBL565583 | 0.70 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2KDM4EMAPTGAA | |
| SCHEMBL587283 | 0.70 | ALDH1A1 (0.57) | ALDH1A1KDM4EMAPTCYP1A2L3MBTL1 | |
| SCHEMBL29915668 | 0.70 | ALDH1A1 (0.57) | ALDH1A1KDM4EMAPTCYP1A2L3MBTL1 | |
| SCHEMBL565971 | 0.70 | CA2 (0.37) | ALDH1A1SMN1; SMN2KDM4EMAPTGAA | |
| SCHEMBL4784858 | 0.70 | ALDH1A1 (0.44) | ALDH1A1SMN1; SMN2KDM4EMAPTGAA | |
| SCHEMBL28409108 | 0.69 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2KDM4EMAPTCYP1A2 |
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-5969179-A | Method for preparing enantiomeric forms of amino alkylaminophenyl propanoic acid | RHONE-POULENC RORER S.A. (FR) | 1999-10-19 | — | — | US | disclosed |