Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 5/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.41 |
| ▸ | RARB | P10826 | 2/20 | 0.38 |
| ▸ | RARA | P10276 | 1/20 | 0.38 |
| ▸ | RARG | P13631 | 1/20 | 0.38 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.38 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.38 |
| ▸ | AXL | P30530 | 1/20 | 0.38 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.37 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.37 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.37 |
| ▸ | CSNK2A3 | Q8NEV1 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9938893 | 0.81 | ESR1 (0.45) | ESR1ESR2RARBHSD17B1HSD17B2 | |
| SCHEMBL9938410 | 0.77 | ESR2 (0.71) | ESR1ESR2RARBHSD17B1HSD17B2 | |
| SCHEMBL14156932 | 0.77 | ESR1 (0.55) | ESR1ESR2RARBHSD17B1HSD17B2 | |
| SCHEMBL14213193 | 0.75 | LMNA (0.57) | RARBAXLRAB9AKMT2ALMNA | |
| SCHEMBL9939166 | 0.73 | MIF (0.49) | ESR1ESR2HSD17B1HSD17B2RAB9A | |
| SCHEMBL1289643 | 0.73 | HSD17B14 (0.49) | ESR1ESR2RARBRARGCSNK2A1 | |
| SCHEMBL9938098 | 0.72 | L3MBTL1 (0.45) | ESR1ESR2AXLCSNK2A1RAB9A | |
| SCHEMBL29038427 | 0.70 | KMT2A (0.51) | RARBAXLRAB9AMEN1KMT2A | |
| SCHEMBL9939322 | 0.70 | ESR1 (0.44) | ESR1ESR2RARBRARARARG | |
| SCHEMBL1289591 | 0.70 | ESR1 (0.43) | ESR1ESR2RARBRARARARG |
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-2012083171-A1 | NOVEL SUBSTITUTED BICYCLIC AROMATIC COMPOUNDS AS S-NITROSOGLUTATHIONE REDUCTASE INHIBITORS | N30 PHARMACEUTICALS, LLC (US) | 2012-06-21 | — | — | WO | disclosed |