Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.51 |
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | STAT1 | P42224 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.45 |
| ▸ | ATIC | P31939 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | KCNB1 | Q14721 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29494447 | 0.90 | MAPT (0.50) | NPC1RAB9AMAPTGAASMN1; SMN2 | |
| SCHEMBL29494547 | 0.89 | RAB9A (0.48) | NPC1RAB9AMAPTGAASMN1; SMN2 | |
| SCHEMBL29494565 | 0.85 | KCNB1 (0.46) | NPC1RAB9AMAPTGAASMN1; SMN2 | |
| SCHEMBL29494496 | 0.80 | MAPT (0.50) | NPC1RAB9AMAPTGAASMN1; SMN2 | |
| SCHEMBL29494552 | 0.76 | ADORA2A (0.43) | NPC1RAB9AMAPTSMN1; SMN2KDM4E | |
| SCHEMBL29494537 | 0.75 | CLK1 (0.52) | SMN1; SMN2MEN1KMT2AHTTKCNH2 | |
| SCHEMBL29494503 | 0.74 | HDAC1 (0.44) | NPC1RAB9ASMN1; SMN2KDM4EMEN1 | |
| SCHEMBL9365921 | 0.72 | KDM4E (0.51) | NPC1RAB9AGAAKDM4EKMT2A | |
| SCHEMBL29494485 | 0.72 | KCNH2 (0.45) | NPC1RAB9AMAPTSMN1; SMN2KDM4E | |
| SCHEMBL3235212 | 0.68 | MTNR1A (0.54) | MEN1KMT2A |
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-2022070048-A1 | NOVEL AMIDE DERIVATIVES | CADILA HEALTHCARE LIMITED (IN) | 2022-04-07 | — | — | WO | disclosed |