Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | NQO1 | P15559 | 1/20 | 0.39 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.36 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.36 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.36 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.36 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | XDH | P47989 | 1/20 | 0.35 |
| ▸ | GALR1 | P47211 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6453900 | 1.00 | RAB9A (0.42) | RAB9ANQO1GRM2NPC1CASP3 | |
| SCHEMBL11277532 | 0.85 | ESR2 (0.49) | RAB9ANQO1GRM2NPC1CASP3 | |
| SCHEMBL6454403 | 0.85 | RAB9A (0.39) | RAB9ANQO1NPC1CASP3SENP8 | |
| SCHEMBL6454406 | 0.85 | RAB9A (0.39) | RAB9ANQO1NPC1CASP3SENP8 | |
| SCHEMBL6451408 | 0.84 | ALDH1A1 (0.38) | RAB9ANPC1MAOAMAOBMAPT | |
| SCHEMBL6453125 | 0.84 | CACNA1G (0.41) | RAB9AESR2 | |
| SCHEMBL6451402 | 0.84 | ALDH1A1 (0.38) | RAB9ANPC1MAOAMAOBMAPT | |
| SCHEMBL6453122 | 0.84 | CACNA1G (0.41) | RAB9AESR2 | |
| SCHEMBL6452768 | 0.84 | ALDH1A1 (0.41) | RAB9ANPC1MAOAMAOBESR2 | |
| SCHEMBL6452773 | 0.84 | ALDH1A1 (0.41) | RAB9ANPC1MAOAMAOBESR2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6913797-B1 | Decahydronaphthalene derivative | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2005-07-05 | — | — | US | disclosed |
| EP-1108700-A1 | DECAHYDRONAPHTHALENE DERIVATIVE | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2001-06-20 | — | — | EP | disclosed |