Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 11/20 | 0.51 |
| ▸ | MAOB | P27338 | 1/20 | 0.51 |
| ▸ | 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 |
| ▸ | BCL2 | P10415 | 4/20 | 0.41 |
| ▸ | BAK1 | Q16611 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 11/20 | 0.40 |
| ▸ | BCL2L1 | Q07817 | 2/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10648165 | 0.84 | USP2 (0.50) | ACHEMAOBCYP3A4TSHRBCL2 | |
| SCHEMBL2059447 | 0.84 | TSHR (0.55) | ACHEMAOBPTGS1PTGS2CYP1A2 | |
| SCHEMBL9690307 | 0.79 | PTGS1 (0.53) | ACHEMAOBPTGS1PTGS2CYP1A2 | |
| SCHEMBL9690451 | 0.78 | TSHR (0.49) | ACHEMAOBPTGS1PTGS2CYP1A2 | |
| SCHEMBL15825618 | 0.77 | CYP3A4 (0.57) | ACHEMAOBPTGS1PTGS2CYP1A2 | |
| SCHEMBL22512408 | 0.77 | CYP3A4 (0.60) | ACHEMAOBPTGS1PTGS2CYP1A2 | |
| SCHEMBL10366019 | 0.75 | MEN1 (0.51) | ACHEMAOBPTGS1PTGS2CYP1A2 | |
| SCHEMBL9690175 | 0.75 | TSHR (0.50) | ACHEPTGS1PTGS2CYP1A2CYP3A4 | |
| SCHEMBL15820153 | 0.75 | CYP3A4 (0.60) | ACHEMAOBPTGS1PTGS2CYP1A2 | |
| SCHEMBL17289288 | 0.75 | CYP3A4 (0.60) | ACHEMAOBPTGS1PTGS2CYP1A2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0487510-A1 | Pharmaceutically active amines | THE UPJOHN COMPANY (US) | 1992-05-27 | — | — | EP | claimed |
| EP-0358676-A1 | PHARMACEUTICALLY ACTIVE AMINES | THE UPJOHN COMPANY (US) | 1990-03-21 | — | — | EP | claimed |
| EP-0293078-A1 | Pharmaceutically active amines | THE UPJOHN COMPANY (US) | 1988-11-30 | — | — | EP | claimed |
| WO-1988008424-A1 | PHARMACEUTICALLY ACTIVE AMINES | THE UPJOHN COMPANY (US) | 1988-11-03 | — | — | WO | claimed |
| EP-0358676-A1 | PHARMACEUTICALLY ACTIVE AMINES | THE UPJOHN COMPANY (US) | 1990-03-21 | — | — | EP | disclosed |
| WO-1988008424-A1 | PHARMACEUTICALLY ACTIVE AMINES | THE UPJOHN COMPANY (US) | 1988-11-03 | — | — | WO | disclosed |