Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.51 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | CES2 | O00748 | 1/20 | 0.50 |
| ▸ | CES1 | P23141 | 1/20 | 0.50 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.49 |
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.47 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.47 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.47 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.47 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL22736822 | 0.83 | NPC1 (0.54) | NPC1RAB9ACES2CES1PARP1 | |
| SCHEMBL19380927 | 0.78 | MEN1 (0.52) | NPC1RAB9ACES2CES1PARP1 | |
| SCHEMBL15164585 | 0.77 | GAA (0.58) | NPC1RAB9ACES2CES1PARP1 | |
| SCHEMBL4637827 | 0.77 | CES2 (0.62) | NPC1RAB9ACES2CES1MTNR1B | |
| SCHEMBL4701315 | 0.75 | NPC1 (0.53) | NPC1RAB9ACES2CES1MTNR1B | |
| SCHEMBL4701313 | 0.75 | NPC1 (0.53) | NPC1RAB9ACES2CES1MTNR1B | |
| SCHEMBL9687402 | 0.74 | CES2 (0.50) | NPC1RAB9ACES2CES1MTNR1B | |
| SCHEMBL6053475 | 0.74 | CES2 (0.50) | NPC1RAB9ACES2CES1MTNR1B | |
| SCHEMBL12083041 | 0.74 | NPC1 (0.76) | NPC1RAB9ACES2CES1PARP1 | |
| SCHEMBL25455101 | 0.73 | NPC1 (0.54) | NPC1RAB9ACES2CES1PARP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3305782-A1 | ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DIODE COMPRISING SAME | SFC Co., Ltd. (KR) | 2018-04-11 | — | — | EP | disclosed |