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 | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 7/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.59 |
| ▸ | TP53 | P04637 | 1/20 | 0.59 |
| ▸ | SCD | O00767 | 7/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | USP2 | O75604 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 4/20 | 0.49 |
| ▸ | RAB9A | P51151 | 4/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL12199473 | 0.91 | SMN1; SMN2 (0.70) | MAPTSMN1; SMN2TP53SCDALDH1A1 | |
| Trifluoromethanesulfonic Acid SCHEMBL2485817 | 0.90 | SMN1; SMN2 (0.60) | MAPTSMN1; SMN2TP53SCDALDH1A1 | |
| SCHEMBL2482852 | 0.88 | SCD (0.66) | MAPTSCDALDH1A1KMT2AMEN1 | |
| Trifluoroacetic Acid SCHEMBL2479571 | 0.87 | SMN1; SMN2 (0.61) | MAPTSMN1; SMN2TP53SCDALDH1A1 | |
| SCHEMBL2479429 | 0.86 | NPC1 (0.60) | MAPTSMN1; SMN2TP53ALDH1A1KMT2A | |
| SCHEMBL2485983 | 0.86 | MAPT (0.56) | MAPTSMN1; SMN2TP53SCDALDH1A1 | |
| SCHEMBL2482534 | 0.82 | MAPT (0.51) | MAPTSMN1; SMN2TP53SCDALDH1A1 | |
| SCHEMBL2481727 | 0.81 | MAPT (0.55) | MAPTSMN1; SMN2TP53SCDALDH1A1 | |
| SCHEMBL12199451 | 0.81 | SMN1; SMN2 (0.62) | MAPTSMN1; SMN2TP53SCDALDH1A1 | |
| Bromide SCHEMBL2482099 | 0.80 | SMN1; SMN2 (0.61) | MAPTSMN1; SMN2TP53SCDALDH1A1 |
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-2376463-A1 | BENZOTHIAZOLE AMIDES FOR DETECTION OF AMYLOID BETA | Bayer Pharma Aktiengesellschaft (DE) | 2011-10-19 | — | — | EP | disclosed |
| WO-2010066357-A1 | BENZOTHIAZOLE AMIDES FOR DETECTION OF AMYLOID BETA | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2010-06-17 | — | — | WO | disclosed |