Known targets — ChEMBL curated mechanism
CHRM1CHRM2CHRM3CHRM4CHRM5SLC6A2dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | NFKBIA | P25963 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | PLAU | P00749 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL13144480 | 0.83 | ACHE (0.54) | ACHEMEN1KMT2AKDM4EMAPT | |
| Trifluoromethanesulfonic Acid SCHEMBL4880071 | 0.83 | KCNH2 (0.44) | ACHEMEN1KMT2AL3MBTL1KDM4E | |
| SCHEMBL11799281 | 0.82 | TERT (0.37) | ACHEKMT2AKDM4ELMNAHTT | |
| SCHEMBL15879541 | 0.82 | PKM (0.47) | ACHEMEN1KMT2AL3MBTL1KDM4E | |
| SCHEMBL18585803 | 0.80 | HTT (0.42) | MEN1KMT2AL3MBTL1KDM4EMAPT | |
| SCHEMBL1001565 | 0.78 | KDM4E (0.46) | L3MBTL1KDM4EMAPTLMNAHTT | |
| SCHEMBL382958 | 0.78 | TERT (0.43) | KDM4EMAPTLMNASMN1; SMN2TDP1 | |
| SCHEMBL11806714 | 0.78 | PTGS2 (0.49) | ACHEMEN1KMT2AMAPTLMNA | |
| SCHEMBL9199430 | 0.76 | MAPT (0.53) | MEN1KMT2AKDM4EMAPTLMNA | |
| SCHEMBL3772670 | 0.72 | MEN1 (0.57) | MEN1KMT2AL3MBTL1KDM4EMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-6579718-B1 | For detecting and quantifying peptides, polypeptides and proteins; sensitive, facile and does not require use of organic solvents | MOLECULAR PROBES, INC. | 2003-06-17 | — | — | US | disclosed |