Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.49 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL15357822 | 0.87 | ALDH1A1 (0.42) | ALDH1A1HPGDCYP2C19FKBP1APDK1 | |
| SCHEMBL17787727 | 0.81 | ALDH1A1 (0.53) | ALDH1A1HPGDCYP2C19FKBP1APDK1 | |
| SCHEMBL12245992 | 0.81 | CHRNB2 (0.53) | ALDH1A1HPGDCYP2C19FKBP1APDK1 | |
| SCHEMBL5986952 | 0.81 | CHRNB2 (0.53) | ALDH1A1HPGDCYP2C19FKBP1APDK1 | |
| SCHEMBL20188773 | 0.79 | ALDH1A1 (0.51) | ALDH1A1HPGDCYP2C19FKBP1APDK1 | |
| SCHEMBL12862060 | 0.79 | ALDH1A1 (0.51) | ALDH1A1HPGDCYP2C19FKBP1APDK1 | |
| SCHEMBL7495998 | 0.79 | FKBP1A (0.53) | ALDH1A1HPGDCYP2C19FKBP1APDK1 | |
| SCHEMBL21561680 | 0.79 | ALDH1A1 (0.51) | ALDH1A1HPGDCYP2C19FKBP1APDK1 | |
| SCHEMBL21543901 | 0.79 | ALDH1A1 (0.51) | ALDH1A1HPGDCYP2C19FKBP1APDK1 | |
| SCHEMBL12862009 | 0.79 | ALDH1A1 (0.52) | ALDH1A1HPGDCYP2C19FKBP1APDK1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6162425-A | Saturated, alkyl-substituted n-mercaptoacetyl heterocyclic compounds and compositions and methods for permanent shaping of hair based on same and processes for making same | WELLA AKTIENGESELLSCHAFT (DE) | 2000-12-19 | — | — | US | claimed |
| EP-0893118-B1 | Saturated alkylsubstituted N-mercaptoacetyl-heterocycles, agent and method for permanently shaping hair based thereon and processes for their preparation | WELLA AG (DE) | 2003-01-29 | — | — | EP | disclosed |
| US-6162425-A | Saturated, alkyl-substituted n-mercaptoacetyl heterocyclic compounds and compositions and methods for permanent shaping of hair based on same and processes for making same | WELLA AKTIENGESELLSCHAFT (DE) | 2000-12-19 | — | — | US | disclosed |
| EP-0893118-A1 | Saturated alkylsubstituted N-mercaptoacetyl-heterocycles, agent and method for permanently shaping hair based thereon and processes for their preparation | Wella Aktiengesellschaft (DE) | 1999-01-27 | — | — | EP | disclosed |