Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 18/20 | 0.47 |
| ▸ | BCHE | P06276 | 17/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7856139 | 0.92 | ACHE (0.47) | ACHEBCHEMAOBPTGS1PTGS2 | |
| SCHEMBL4401509 | 0.88 | ACHE (0.46) | ACHEBCHEMAOBPTGS1PTGS2 | |
| Hydrochloric Acid SCHEMBL4411888 | 0.88 | ACHE (0.45) | ACHEBCHEMAOBPTGS1PTGS2 | |
| SCHEMBL9312837 | 0.81 | PTGS1 (0.55) | ACHEBCHEMAOBPTGS1PTGS2 | |
| SCHEMBL2058864 | 0.81 | PTGS1 (0.60) | ACHEBCHEMAOBPTGS1PTGS2 | |
| SCHEMBL4412022 | 0.81 | ACHE (0.46) | ACHEBCHEMAOBPTGS1PTGS2 | |
| Hydrochloric Acid SCHEMBL4396247 | 0.80 | ACHE (0.45) | ACHEBCHEMAOBPTGS1PTGS2 | |
| SCHEMBL2059364 | 0.80 | PTGS1 (0.58) | ACHEBCHEMAOBPTGS1PTGS2 | |
| Hydrochloric Acid SCHEMBL4491799 | 0.80 | ACHE (0.44) | ACHEBCHEMAOBPTGS1PTGS2 | |
| SCHEMBL4319066 | 0.78 | PTGS1 (0.49) | ACHEBCHEMAOBPTGS1PTGS2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1115719-A2 | NOVEL AMIDINE DERIVATIVES, THEIR PREPARATION AND APPLICATION AS MEDICINES AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) | 2001-07-18 | — | — | EP | disclosed |
| WO-2000017190-A2 | AMIDINE DERIVATIVES, THEIR PREPARATION AND APPLICATION AS MEDICINES AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) | 2000-03-30 | — | — | WO | disclosed |