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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 3/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | RAD52 | P43351 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3399516 | 0.99 | CNR2 (0.45) | CNR2CNR1MAPTALDH1A1RECQL | |
| SCHEMBL3400103 | 0.93 | KMT2A (0.37) | CNR2CNR1MAPTALDH1A1KMT2A | |
| SCHEMBL3396027 | 0.93 | MAPT (0.41) | CNR2CNR1MAPTALDH1A1KMT2A | |
| SCHEMBL3424151 | 0.92 | HTR6 (0.40) | CNR2CNR1MAPTALDH1A1KMT2A | |
| SCHEMBL3425990 | 0.87 | CNR2 (0.47) | CNR2CNR1MAPTALDH1A1RECQL | |
| SCHEMBL3421102 | 0.85 | CHKA (0.36) | MAPTALDH1A1KMT2AMEN1ACHE | |
| SCHEMBL3396612 | 0.85 | ACHE (0.51) | CNR2CNR1MAPTALDH1A1RECQL | |
| Hydrochloric Acid SCHEMBL3399953 | 0.84 | CHKA (0.36) | MAPTALDH1A1KMT2AMEN1ACHE | |
| Bromide SCHEMBL3393302 | 0.84 | CHKA (0.39) | MAPTALDH1A1KMT2AMEN1ACHE | |
| SCHEMBL3424395 | 0.84 | CHKA (0.38) | MAPTALDH1A1RECQLKMT2AMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2245013-A1 | 9-Ý4-(AMINO) PHENYL¨ACRIDINIUM SALTS AS CATIONIC DIRECT DYES FOR COLORING KERATINOUS FIBERS | Henkel AG & Co. KGaA (DE) | 2010-11-03 | — | — | EP | disclosed |
| WO-2009103798-A1 | 9-[4-(AMINO) PHENYL] ACRIDINIUM SALTS AS CATIONIC DIRECT DYES FOR COLORING KERATINOUS FIBERS | HENKEL AG & CO. KGAA (DE) | 2009-08-27 | — | — | WO | disclosed |