Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 1/20 | 0.53 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.48 |
| ▸ | ACACB | O00763 | 5/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | USP30 | Q70CQ3 | 2/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.41 |
| ▸ | GPR183 | P32249 | 1/20 | 0.41 |
| ▸ | SPR | P35270 | 4/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | TNKS | O95271 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8326656 | 0.95 | CYP11B2 (0.48) | CYP11B2SCD5ACACBSIGMAR1USP30 | |
| SCHEMBL8325258 | 0.94 | CYP11B2 (0.53) | CYP11B2SCD5ACACBSIGMAR1USP30 | |
| SCHEMBL615033 | 0.78 | SIGMAR1 (0.63) | SIGMAR1 | |
| SCHEMBL6715677 | 0.77 | HTR2A (0.53) | SIGMAR1CHRM2CHRM4CHRM1CHRM3 | |
| SCHEMBL14742358 | 0.72 | SCD5 (0.64) | CYP11B2SCD5ACACBUSP30TNKS | |
| SCHEMBL8320735 | 0.72 | SIGMAR1 (0.39) | SIGMAR1USP30 | |
| SCHEMBL6868004 | 0.71 | CYP11B2 (0.54) | CYP11B2SCD5ACACBUSP30HDAC2 | |
| SCHEMBL19838586 | 0.71 | CYP3A4 (0.66) | CYP11B2SCD5USP30 | |
| SCHEMBL23902054 | 0.71 | MAPK1 (0.51) | CYP11B2SCD5CHRM2CHRM4CHRM1 | |
| SCHEMBL29609790 | 0.71 | MAPK1 (0.51) | CYP11B2SCD5CHRM2CHRM4CHRM1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0470490-B1 | Substituted pyrroles | HOFFMANN LA ROCHE (CH) | 1999-05-06 | — | — | EP | disclosed |
| US-5292747-A | Substituted pyrroles | HOFFMAN-LA ROCHE INC. (US) | 1994-03-08 | — | — | US | disclosed |
| EP-0470490-A1 | Substituted pyrroles | F. HOFFMANN-LA ROCHE AG (CH) | 1992-02-12 | — | — | EP | disclosed |