Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 4/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.54 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.54 |
| ▸ | CNR2 | P34972 | 3/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL29838955 | 0.94 | CYP1A2 (0.57) | CNR1CYP1A2HIF1APTGS2CNR2 | |
| SCHEMBL277784 | 0.94 | CNR1 (0.62) | CNR1CYP1A2HIF1APTGS2CNR2 | |
| Hydrochloric Acid SCHEMBL278149 | 0.93 | CNR1 (0.61) | CNR1CYP1A2HIF1APTGS2CNR2 | |
| SCHEMBL2915869 | 0.90 | CYP2C9 (0.63) | CNR1CYP1A2CNR2CYP2C9CYP2C19 | |
| SCHEMBL16197630 | 0.88 | CNR1 (0.57) | CNR1CNR2CYP2C9CYP2C19 | |
| SCHEMBL25197049 | 0.85 | MDM2 (0.62) | CNR1CYP1A2HIF1ACNR2CYP2C9 | |
| SCHEMBL12918610 | 0.85 | CNR2 (0.59) | CNR1CNR2 | |
| SCHEMBL277080 | 0.85 | CNR1 (0.54) | CNR1CYP1A2HIF1APTGS2CNR2 | |
| SCHEMBL18353073 | 0.84 | CNR1 (0.54) | CNR1CYP1A2CNR2CYP2C9CYP2C19 | |
| SCHEMBL4885515 | 0.84 | RPA1 (0.57) | CNR1PTGS2CNR2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2014174457-A1 | PYRAZOLE CARBOXYLIC ACID ANALOGUES AS ANTI-MYCOBACTERIAL DRUG CANDIDATES | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2014-10-30 | — | — | WO | claimed |
| WO-2014174457-A1 | PYRAZOLE CARBOXYLIC ACID ANALOGUES AS ANTI-MYCOBACTERIAL DRUG CANDIDATES | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2014-10-30 | — | — | WO | disclosed |
| WO-2014174457-A1 | PYRAZOLE CARBOXYLIC ACID ANALOGUES AS ANTI-MYCOBACTERIAL DRUG CANDIDATES | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2014-10-30 | — | — | WO | disclosed |