Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | NQO1 | P15559 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.37 |
| ▸ | XDH | P47989 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | MPI | P34949 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ACACB | O00763 | 7/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8774805 | 0.96 | NQO1 (0.41) | CYP11B1CYP11B2NQO1ACACBSYK | |
| SCHEMBL8774463 | 0.90 | MCHR1 (0.41) | ALDH1A1RAB9ANPC1MCHR1GAA | |
| SCHEMBL8775170 | 0.90 | CYP2D6 (0.46) | KDM4EALDH1A1RAB9ANPC1LMNA | |
| SCHEMBL8774435 | 0.85 | ACACB (0.40) | LMNAHSD17B10CHRNA7ACACB | |
| SCHEMBL8774602 | 0.85 | ACACB (0.39) | KDM4EALDH1A1RAB9ALMNAHPGD | |
| SCHEMBL8774750 | 0.83 | FFAR1 (0.38) | RAB9ANPC1GAASMN1; SMN2ACACB | |
| SCHEMBL8774095 | 0.83 | NR5A1 (0.41) | KDM4EALDH1A1RAB9ANPC1LMNA | |
| SCHEMBL9158464 | 0.82 | NQO1 (0.39) | CYP11B1CYP11B2NQO1KDM4EALDH1A1 | |
| SCHEMBL8774387 | 0.81 | APP (0.46) | CYP11B1CYP11B2ALDH1A1MCHR1ACACB | |
| SCHEMBL8774994 | 0.81 | FFAR1 (0.42) | RAB9ANPC1SMN1; SMN2HSD17B10MAPT |
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-0519370-B1 | Heterocyclic derivatives | MERCK PATENT GMBH (DE) | 1997-11-05 | — | — | EP | disclosed |
| EP-0519370-A2 | Heterocyclic derivatives | MERCK PATENT GmbH (DE) | 1992-12-23 | — | — | EP | disclosed |