Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.61 |
| ▸ | NPC1 | O15118 | 2/20 | 0.61 |
| ▸ | RAB9A | P51151 | 2/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.61 |
| ▸ | MAPT | P10636 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | FAAH | O00519 | 6/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.57 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | MGLL | Q99685 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | ALPL | P05186 | 2/20 | 0.52 |
| ▸ | ALPI | P09923 | 2/20 | 0.52 |
| ▸ | ABL1 | P00519 | 1/20 | 0.52 |
| ▸ | ALPG | P10696 | 1/20 | 0.52 |
| ▸ | RIN1 | Q13671 | 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 | |
|---|---|---|---|---|
| SCHEMBL28778471 | 0.90 | FAAH (0.61) | SMN1; SMN2FAAHKMT2ANLRP3TRPV1 | |
| SCHEMBL28778484 | 0.90 | SMN1; SMN2 (0.75) | SMN1; SMN2NPC1RAB9AKDM4EMAPT | |
| SCHEMBL28778491 | 0.90 | FAAH (0.58) | SMN1; SMN2NPC1RAB9AFAAHKMT2A | |
| SCHEMBL28778485 | 0.85 | FAAH (0.61) | NPC1RAB9AFAAHKMT2AMEN1 | |
| SCHEMBL28778498 | 0.82 | FAAH (0.64) | FAAHKMT2ATRPV1 | |
| SCHEMBL20236529 | 0.82 | MAPT (0.71) | SMN1; SMN2NPC1RAB9AKDM4EMAPT | |
| SCHEMBL1553421 | 0.79 | KMT2A (0.63) | KMT2ATRPV1MEN1MGLLALPL | |
| SCHEMBL8223191 | 0.77 | FAAH (0.82) | SMN1; SMN2NPC1RAB9AKDM4EMAPT | |
| SCHEMBL30250097 | 0.76 | KMT2A (0.68) | KMT2AMGLLALPLALPIABL1 | |
| SCHEMBL13713102 | 0.76 | MEN1 (0.67) | SMN1; SMN2NPC1RAB9AKDM4EMAPT |
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-114751874-A | 1-benzyl-4-ethylpiperazine derivatives as TRPV4-KCa2.3 coupling promoting agents and application thereof | 江南大学 | 2022-07-15 | — | — | CN | disclosed |