Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 3/20 | 0.43 |
| ▸ | ACHE | P22303 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | RORC | P51449 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | MTOR | P42345 | 1/20 | 0.38 |
| ▸ | CASR | P41180 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL7536030 | 0.85 | NPC1 (0.58) | NPC1RAB9ASMN1; SMN2ALDH1A1KCNH2 | |
| SCHEMBL7536034 | 0.85 | NPC1 (0.58) | NPC1RAB9ASMN1; SMN2ALDH1A1KCNH2 | |
| SCHEMBL7688371 | 0.85 | POLB (0.54) | NPC1RAB9ASMN1; SMN2ALDH1A1KCNH2 | |
| SCHEMBL6321494 | 0.85 | POLB (0.54) | NPC1RAB9ASMN1; SMN2ALDH1A1KCNH2 | |
| SCHEMBL7024089 | 0.82 | SMN1; SMN2 (0.51) | BCHEACHENPC1RAB9ASMN1; SMN2 | |
| SCHEMBL7610964 | 0.79 | NPC1 (0.46) | NPC1RAB9ASMN1; SMN2ALDH1A1KCNH2 | |
| SCHEMBL6322792 | 0.79 | NPC1 (0.46) | NPC1RAB9ASMN1; SMN2ALDH1A1KCNH2 | |
| SCHEMBL7610290 | 0.76 | POLB (0.57) | NPC1RAB9ASMN1; SMN2ALDH1A1KCNH2 | |
| SCHEMBL6324058 | 0.76 | NPC1 (0.44) | BCHEACHENPC1RAB9ASMN1; SMN2 | |
| SCHEMBL7024942 | 0.75 | ALDH1A1 (0.53) | NPC1RAB9ASMN1; SMN2ALDH1A1KCNH2 |
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-2002036552-A1 | AMINOALCOHOL DERIVATIVES AND THEIR USE AS BETA 3 ADRENERGIC AGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2002-05-10 | — | — | WO | disclosed |