Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 7/20 | 0.46 |
| ▸ | DAO | P14920 | 1/20 | 0.46 |
| ▸ | HCAR3 | P49019 | 3/20 | 0.36 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 6/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 6/20 | 0.36 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | ALPL | P05186 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.33 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1206525 | 0.72 | HCAR2 (0.35) | HCAR2DAOHCAR3ALPLL3MBTL1 | |
| SCHEMBL1531197 | 0.69 | HCAR2 (0.42) | HCAR2DAOHCAR3AKR1C3AKR1C2 | |
| SCHEMBL16619099 | 0.68 | BRD4 (0.39) | HCAR2DAOCCNA2CDK2CCNA1 | |
| SCHEMBL16619580 | 0.68 | HCAR2 (0.32) | HCAR2DAOALPLL3MBTL1 | |
| SCHEMBL26775764 | 0.68 | CYP1A2 (0.34) | HCAR2DAOL3MBTL1 | |
| SCHEMBL3740712 | 0.68 | AKR1C3 (0.40) | AKR1C3AKR1C2AKR1C1PTGS1 | |
| SCHEMBL15218944 | 0.67 | HCAR2 (0.62) | HCAR2DAOHCAR3ALPLL3MBTL1 | |
| SCHEMBL10761856 | 0.67 | AKR1C3 (0.36) | HCAR3AKR1C3AKR1C2AKR1C1PTGS1 | |
| SCHEMBL31554349 | 0.67 | AKR1C3 (0.33) | AKR1C3AKR1C2AKR1C1PTGS1 | |
| SCHEMBL804646 | 0.66 | — | — |
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-0879234-A1 | 1-PYRAZOL-3-YL-ETHYL-4-INDOL-3-YL-PIPERIDINE USED AS MEDICINE ACTING ON THE CENTRAL NERVOUS SYSTEM | MERCK PATENT GmbH (DE) | 1998-11-25 | — | — | EP | disclosed |
| WO-1997027186-A1 | 1-PYRAZOL-3-YL-ETHYL-4-INDOL-3-YL-PIPERIDINE USED AS MEDICINE ACTING ON THE CENTRAL NERVOUS SYSTEM | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1997-07-31 | — | — | WO | disclosed |