Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.48 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.48 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.48 |
| ▸ | ELANE | P08246 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.46 |
| ▸ | PARP1 | P09874 | 1/20 | 0.45 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.44 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL822797 | 0.89 | NPC1 (0.57) | NPC1RAB9AADRB2ADRB1ADRB3 | |
| SCHEMBL28104689 | 0.84 | ALDH1A1 (0.49) | NPC1RAB9AADRB2ADRB1ADRB3 | |
| SCHEMBL29360475 | 0.82 | TDP1 (0.60) | NPC1RAB9AADRB2ADRB1ADRB3 | |
| SCHEMBL570920 | 0.82 | TDP1 (0.60) | NPC1RAB9AADRB2ADRB1ADRB3 | |
| SCHEMBL23817378 | 0.81 | ALDH1A1 (0.52) | NPC1RAB9AADRB2ADRB1ADRB3 | |
| SCHEMBL6057282 | 0.81 | LMNA (0.66) | NPC1RAB9AADRB2ADRB1ADRB3 | |
| Ammonia Solution, Strong SCHEMBL27753074 | 0.80 | TDP1 (0.59) | NPC1RAB9AADRB2ADRB1ADRB3 | |
| Hydrochloric Acid SCHEMBL28864124 | 0.80 | L3MBTL1 (0.59) | NPC1RAB9AADRB2ADRB1ADRB3 | |
| SCHEMBL19354448 | 0.79 | ADRB2 (0.53) | NPC1RAB9AADRB2ADRB1ADRB3 | |
| SCHEMBL9044225 | 0.79 | L3MBTL1 (0.61) | NPC1RAB9AADRB2ADRB1ADRB3 |
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-2023274246-A1 | AMIDE COMPOUND AND USE THEREOF | 成都分迪药业有限公司 | 2023-01-05 | — | — | WO | disclosed |