Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | CES2 | O00748 | 1/20 | 0.45 |
| ▸ | CES1 | P23141 | 1/20 | 0.45 |
| ▸ | CTRC | Q99895 | 1/20 | 0.45 |
| ▸ | CNR1 | P21554 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | MGLL | Q99685 | 2/20 | 0.41 |
| ▸ | VCP | P55072 | 1/20 | 0.41 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
| ▸ | EDNRB | P24530 | 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 | |
|---|---|---|---|---|
| SCHEMBL7823315 | 0.87 | LMNA (0.67) | LMNACES2CES1KDM4EGAA | |
| SCHEMBL8190432 | 0.83 | OPRK1 (0.49) | LMNAVCPMAOBSLC6A3TSHR | |
| Bicarbonate SCHEMBL27486769 | 0.78 | CYP1A2 (0.79) | CYP1A2LMNACES2CES1CTRC | |
| SCHEMBL8179771 | 0.78 | ALDH1A1 (0.51) | CYP1A2LMNAKDM4EL3MBTL1TSHR | |
| SCHEMBL14957913 | 0.72 | TPMT (0.44) | LMNASLC6A3 | |
| SCHEMBL4454036 | 0.72 | CYP1A2 (1.00) | CYP1A2LMNACTRCKDM4EGAA | |
| SCHEMBL183912 | 0.72 | CYP1A2 (1.00) | CYP1A2LMNACTRCKDM4EGAA | |
| SCHEMBL10874927 | 0.71 | SRD5A2 (0.65) | CYP1A2LMNACES2CES1CTRC | |
| SCHEMBL9647503 | 0.71 | CES2 (0.79) | CYP1A2CES2CES1CTRCKDM4E | |
| SCHEMBL2918529 | 0.71 | LMNA (0.52) | LMNAGAASLC6A3TSHR |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6020519-A | Diphenyl-cyclopropenes as selective K-agonists | WARNER-LAMBERT COMPANY (US) | 2000-02-01 | — | — | US | claimed |
| WO-1998003491-A1 | DIPHENYL-CYCLOPROPENES AS SELECTIVE K-AGONISTS | WARNER-LAMBERT COMPANY (US) | 1998-01-29 | — | — | WO | claimed |
| US-6020519-A | Diphenyl-cyclopropenes as selective K-agonists | WARNER-LAMBERT COMPANY (US) | 2000-02-01 | — | — | US | disclosed |
| US-5968968-A | Diphenyl-cyclopropenes as selective K-agonists | WARNER-LAMBERT COMPANY (US) | 1999-10-19 | — | — | US | disclosed |
| WO-1998003491-A1 | DIPHENYL-CYCLOPROPENES AS SELECTIVE K-AGONISTS | WARNER-LAMBERT COMPANY (US) | 1998-01-29 | — | — | WO | disclosed |