Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.34 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.34 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.34 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | GCGR | P47871 | 1/20 | 0.30 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.30 |
| ▸ | PDE5A | O76074 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9828942 | 0.96 | ESR2 (0.40) | ESR2NPC1CASP3RAB9ASENP8 | |
| SCHEMBL10600526 | 0.91 | ESR2 (0.40) | ESR2BACE1HRH3GCGRPDE5A | |
| SCHEMBL22122631 | 0.89 | ESR2 (0.41) | ESR2NPC1CASP3RAB9ASENP8 | |
| SCHEMBL15255856 | 0.89 | ESR2 (0.41) | ESR2NPC1CASP3RAB9ASENP8 | |
| SCHEMBL31279683 | 0.89 | ESR2 (0.41) | ESR2NPC1CASP3RAB9ASENP8 | |
| SCHEMBL10015003 | 0.88 | ESR2 (0.40) | ESR2NPC1CASP3RAB9ASENP8 | |
| SCHEMBL11190434 | 0.86 | ESR2 (0.54) | ESR2NPC1CASP3RAB9ASENP8 | |
| SCHEMBL11157193 | 0.85 | TLR4 (0.34) | ESR2NPC1CASP3RAB9ASENP8 | |
| SCHEMBL11157196 | 0.85 | TLR4 (0.34) | ESR2NPC1CASP3RAB9ASENP8 | |
| SCHEMBL8932614 | 0.85 | ESR2 (0.42) | ESR2NPC1CASP3RAB9ASENP8 |
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 |
|---|---|---|---|---|---|---|---|
| JP-8003083-A | — | — | None | — | — | JP | disclosed |
| JP-H083083-A | CYCLOHEXENE DERIVATIVE | ASAHI DENKA KOGYO KK | 1996-01-09 | — | — | JP | disclosed |