Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARG | Q86W56 | 4/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.52 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.52 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.47 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL2680469 | 0.92 | CYP1A2 (0.54) | PARGALDH1A1CYP1A2CRHR1CRHR2 | |
| SCHEMBL25720574 | 0.85 | CYP1A2 (0.48) | PARGALDH1A1CYP1A2CRHR1CRHR2 | |
| SCHEMBL12434220 | 0.84 | OPRL1 (0.66) | PARGALDH1A1KDM4ENPSR1HSD17B10 | |
| Hydrochloric Acid SCHEMBL2264513 | 0.84 | CRHR1 (0.47) | PARGALDH1A1CYP1A2CRHR1CRHR2 | |
| SCHEMBL11247925 | 0.83 | BRD4 (0.52) | PARGCYP1A2KMT2A | |
| SCHEMBL12434209 | 0.80 | CRHR1 (0.52) | PARGALDH1A1KDM4ENPSR1HSD17B10 | |
| SCHEMBL12434217 | 0.80 | ALDH1A1 (0.49) | PARGALDH1A1KDM4ENPSR1HSD17B10 | |
| SCHEMBL24405966 | 0.80 | OPRL1 (0.68) | ALDH1A1KDM4ENPSR1HSD17B10OPRM1 | |
| SCHEMBL11949817 | 0.78 | CRHR1 (0.51) | ALDH1A1HSD17B10HPGDCRHR1CRHR2 | |
| SCHEMBL2149287 | 0.77 | OPRM1 (0.46) | OPRM1OPRK1OPRL1TSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011092293-A2 | CYCLOHEXYL AMIDE DERIVATIVES AS CRF RECEPTOR ANTAGONISTS | NOVARTIS AG (CH) | 2011-08-04 | — | — | WO | disclosed |