Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.52 |
| ▸ | IDO1 | P14902 | 3/20 | 0.50 |
| ▸ | PNMT | P11086 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.42 |
| ▸ | HTR3B | O95264 | 1/20 | 0.42 |
| ▸ | HTR3A | P46098 | 1/20 | 0.42 |
| ▸ | HTR3D | Q70Z44 | 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 | |
|---|---|---|---|---|
| SCHEMBL126469 | 0.90 | — | — | |
| SCHEMBL2520376 | 0.87 | IDO1 (0.56) | TAAR1IDO1PNMTSMN1; SMN2RAB9A | |
| Hydrochloric Acid SCHEMBL29120628 | 0.87 | IDO1 (0.56) | TAAR1IDO1PNMTSMN1; SMN2RAB9A | |
| SCHEMBL5345971 | 0.87 | IDO1 (0.56) | TAAR1IDO1PNMTSMN1; SMN2RAB9A | |
| Ammonia Solution, Strong SCHEMBL21633813 | 0.87 | IDO1 (0.56) | TAAR1IDO1PNMTSMN1; SMN2RAB9A | |
| Cyanide SCHEMBL28154275 | 0.83 | IDO1 (0.52) | TAAR1IDO1PNMTSMN1; SMN2RAB9A | |
| SCHEMBL27739733 | 0.80 | ESR2 (0.48) | TAAR1SMN1; SMN2CYP2A6HIF1ACYP1A2 | |
| SCHEMBL6308178 | 0.80 | ESR2 (0.53) | TAAR1SMN1; SMN2CYP2A6CYP1A2ALDH1A1 | |
| SCHEMBL6740216 | 0.76 | TAAR1 (0.71) | TAAR1IDO1PNMTSLC6A2SLC6A4 | |
| Biphenyl SCHEMBL27751393 | 0.76 | TSHR (0.71) | TAAR1SMN1; SMN2CYP2A6L3MBTL1CYP1A2 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-57120571-A | — | — | None | — | — | JP | disclosed |
| CN-104619717-A | Synthesis of beta-turn peptidomimetic cyclic compounds | MIMETOGEN PHARMACEUTICALS INC | 2015-05-13 | — | — | CN | disclosed |
| CN-102225966-B | Method for solid phase peptide synthesis | LONZA AG | 2012-12-26 | — | — | CN | disclosed |
| CN-102225966-A | Method for solid phase peptide synthesis | LONZA AG | 2011-10-26 | — | — | CN | disclosed |
| CN-101094867-B | Method for solid phase peptide synthesis | LONZA AG | 2011-08-24 | — | — | CN | disclosed |
| CN-101094867-A | Method for solid phase peptide synthesis | LONZA AG (CH) | 2007-12-26 | — | — | CN | disclosed |
| JP-S57120571-A | PREPARATION OF BISPHENYL 2- CHLOROPHENYLIMIDAZOYLMETHANE | KOTOBUKI SEIYAKU KK | 1982-07-27 | — | — | JP | disclosed |