Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Proline. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.47 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | CCR5 | P51681 | 6/20 | 0.32 |
| ▸ | CCR2 | P41597 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SCN4A | P35499 | 1/20 | 0.31 |
| ▸ | CCR8 | P51685 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL368247 | 0.87 | GPBAR1 (0.52) | GPBAR1BRD4LMNAMEN1CYP1A2 | |
| SCHEMBL369537 | 0.87 | GPBAR1 (0.52) | GPBAR1BRD4LMNAMEN1CYP1A2 | |
| SCHEMBL368246 | 0.87 | GPBAR1 (0.52) | GPBAR1BRD4LMNAMEN1CYP1A2 | |
| SCHEMBL14891642 | 0.78 | BRD4 (0.45) | GPBAR1BRD4LMNAMEN1CYP1A2 | |
| SCHEMBL14891644 | 0.78 | BRD4 (0.45) | GPBAR1BRD4LMNAMEN1CYP1A2 | |
| SCHEMBL1390379 | 0.77 | GPBAR1 (0.42) | GPBAR1BRD4CCR2LMNAMEN1 | |
| SCHEMBL368673 | 0.77 | APAF1 (0.41) | GPBAR1BRD4 | |
| SCHEMBL368674 | 0.77 | APAF1 (0.41) | GPBAR1BRD4 | |
| SCHEMBL1390094 | 0.77 | GPBAR1 (0.45) | GPBAR1BRD4MEN1CYP1A2CYP3A4 | |
| SCHEMBL368091 | 0.76 | GPBAR1 (0.54) | GPBAR1BRD4CCR2 |
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-2593426-A1 | 1-HYDROXYIMINO-3-PHENYL-PROPANES | F.HOFFMANN-LA ROCHE AG (CH) | 2013-05-22 | — | — | EP | disclosed |
| WO-2012007365-A1 | 1-HYDROXYIMINO-3-PHENYL-PROPANES | F. HOFFMANN-LA ROCHE AG (CH) | 2012-01-19 | — | — | WO | disclosed |