Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.61 |
| ▸ | RAB9A | P51151 | 4/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.61 |
| ▸ | TP53 | P04637 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | MEN1 | O00255 | 5/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 3/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.52 |
| ▸ | THRB | P10828 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL28523859 | 1.00 | NPC1 (0.61) | NPC1RAB9ASMN1; SMN2TP53TSHR | |
| SCHEMBL30944319 | 0.89 | KMT2A (0.61) | NPC1RAB9ASMN1; SMN2TP53TSHR | |
| SCHEMBL30944342 | 0.82 | NPC1 (0.57) | NPC1RAB9ASMN1; SMN2TP53MEN1 | |
| SCHEMBL30944356 | 0.76 | RAB9A (0.72) | NPC1RAB9ASMN1; SMN2TP53MAPT | |
| SCHEMBL14450431 | 0.76 | NPC1 (0.59) | NPC1RAB9ASMN1; SMN2TP53TSHR | |
| SCHEMBL21821838 | 0.76 | MAPT (0.76) | NPC1RAB9ASMN1; SMN2TP53TSHR | |
| SCHEMBL30944321 | 0.75 | SMN1; SMN2 (0.58) | NPC1RAB9ASMN1; SMN2TP53TSHR | |
| SCHEMBL13723979 | 0.75 | MAPT (0.74) | NPC1RAB9ASMN1; SMN2TP53TSHR | |
| SCHEMBL30944333 | 0.74 | NPC1 (0.60) | NPC1RAB9ASMN1; SMN2TP53MEN1 | |
| SCHEMBL30944345 | 0.74 | CASP3 (0.72) | NPC1RAB9ASMN1; SMN2MEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118772080-A | Antimycobacterial heterocyclic amides | 克莱斯通公司 | 2024-10-15 | — | — | CN | claimed |
| CN-118772080-A | Antimycobacterial heterocyclic amides | 克莱斯通公司 | 2024-10-15 | — | — | CN | disclosed |
| CN-112423746-B | Novel antimycobacterial heterocyclic amides | 克莱斯通公司 | 2024-06-28 | — | — | CN | disclosed |