Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ECE1 | P42892 | 8/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MME | P08473 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | AHR | P35869 | 2/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | MMP12 | P39900 | 1/20 | 0.34 |
| ▸ | MMP13 | P45452 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4352052 | 0.76 | ECE1 (0.71) | ECE1MEN1KMT2AMME | |
| SCHEMBL13866598 | 0.76 | ECE1 (0.71) | ECE1MEN1KMT2AMME | |
| SCHEMBL7507014 | 0.75 | CYP1A2 (0.54) | MEN1KMT2AHPGDALDH1A1CYP2D6 | |
| SCHEMBL6785583 | 0.75 | CYP1A2 (0.54) | MEN1KMT2AHPGDALDH1A1CYP2D6 | |
| Hydrochloric Acid SCHEMBL6791172 | 0.73 | CYP1A2 (0.53) | MEN1KMT2AHPGDALDH1A1CYP2D6 | |
| SCHEMBL7143643 | 0.73 | CYP1A2 (0.45) | ECE1MEN1KMT2AMMEHPGD | |
| SCHEMBL25764592 | 0.70 | ECE1 (0.54) | ECE1MEN1KMT2AMMEMAPT | |
| SCHEMBL13883027 | 0.69 | ECE1 (0.59) | ECE1MEN1KMT2AMMEKDM4E | |
| SCHEMBL7962303 | 0.69 | GHSR (0.38) | ECE1MEN1KMT2AMMEMAPT | |
| SCHEMBL7962305 | 0.69 | GHSR (0.38) | ECE1MEN1KMT2AMMEMAPT |
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-2001077095-A2 | DERIVATIVES OF ALPHA-MERCAPTOACETAMIDE | NOVARTIS AG (CH) | 2001-10-18 | — | — | WO | disclosed |