Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 7/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28536922 | 0.86 | NPC1 (0.46) | NPC1RAB9ALMNASMN1; SMN2MEN1 | |
| SCHEMBL28539545 | 0.86 | CXCR4 (0.47) | MEN1KMT2AALDH1A1 | |
| SCHEMBL28533699 | 0.86 | PTPN1 (0.42) | NPC1RAB9ALMNASMN1; SMN2MEN1 | |
| SCHEMBL29113836 | 0.86 | TPSAB1 (0.43) | NPC1RAB9ALMNASMN1; SMN2TRPV1 | |
| SCHEMBL29113862 | 0.85 | TRPV1 (0.40) | NPC1RAB9ALMNASMN1; SMN2TRPV1 | |
| SCHEMBL28551665 | 0.82 | TRPV1 (0.40) | NPC1RAB9ALMNASMN1; SMN2TRPV1 | |
| SCHEMBL30541778 | 0.81 | NPC1 (0.44) | NPC1RAB9ALMNASMN1; SMN2MEN1 | |
| Hydrochloric Acid SCHEMBL29113808 | 0.81 | MEN1 (0.45) | NPC1RAB9ATRPV1MEN1KMT2A | |
| SCHEMBL28530193 | 0.80 | KEAP1 (0.44) | NPC1RAB9ALMNASMN1; SMN2TRPV1 | |
| SCHEMBL28535807 | 0.79 | NPC1 (0.46) | NPC1RAB9ALMNASMN1; SMN2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112574089-A | Photoinduced multifunctional cross-linking agent, and preparation method and application thereof | 中国科学院上海药物研究所 | 2021-03-30 | — | — | CN | disclosed |