Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 8/20 | 0.62 |
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | F2 | P00734 | 1/20 | 0.58 |
| ▸ | REN | P00797 | 1/20 | 0.58 |
| ▸ | LTA4H | P09960 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | PEPD | P12955 | 1/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.58 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.58 |
| ▸ | HTR2A | P28223 | 1/20 | 0.58 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.58 |
| ▸ | HRH1 | P35367 | 1/20 | 0.58 |
| ▸ | THPO | P40225 | 1/20 | 0.58 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.58 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.58 |
| ▸ | MVD | P53602 | 2/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL683102 | 1.00 | ACE (0.62) | ACELMNAHSD17B10CYP2C19KDM4E | |
| SCHEMBL7381081 | 0.94 | ACE (0.56) | ACELMNAHSD17B10CYP2C19KDM4E | |
| SCHEMBL7374901 | 0.88 | ACE (0.47) | ACELMNAHSD17B10CYP2C19KDM4E | |
| SCHEMBL683432 | 0.85 | ACE (0.69) | ACELMNAHSD17B10CYP2C19KDM4E | |
| SCHEMBL6789984 | 0.85 | ACE (0.69) | ACELMNAHSD17B10CYP2C19KDM4E | |
| SCHEMBL6789982 | 0.85 | ACE (0.69) | ACELMNAHSD17B10CYP2C19KDM4E | |
| SCHEMBL6782701 | 0.84 | ACE (0.72) | ACERENMVD | |
| SCHEMBL6782705 | 0.84 | ACE (0.72) | ACERENMVD | |
| SCHEMBL10797994 | 0.83 | ACE (0.53) | ACELMNAHSD17B10CYP2C19KDM4E | |
| SCHEMBL683796 | 0.83 | DPP4 (0.46) | ACE |
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 |
|---|---|---|---|---|---|---|---|
| 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 |
| US-4209617-A | 6,7-Dihydro-8H-pyrrolo[2,1-c][1,4]thiazine-1(8aH),4(3H)-dione | MORTON-NORWICH PRODUCTS, INC. (US) | 1980-06-24 | — | — | US | disclosed |