Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 5/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | EDNRB | P24530 | 2/20 | 0.40 |
| ▸ | EDNRA | P25101 | 2/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | MLNR | O43193 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL251299 | 0.79 | CES1 (0.47) | KMT2AMAPTLMNACYP2D6CYP3A4 | |
| SCHEMBL4561863 | 0.78 | CHRM2 (0.51) | KMT2AMAPTLMNACYP2D6CYP3A4 | |
| SCHEMBL935072 | 0.78 | CES1 (0.46) | KMT2AMAPTLMNACYP2D6CYP3A4 | |
| SCHEMBL29277787 | 0.77 | CYP3A4 (0.40) | KMT2ALMNACYP2D6CYP3A4CES1 | |
| SCHEMBL20293767 | 0.77 | MAPT (0.47) | KMT2AMAPTLMNACYP2D6CYP3A4 | |
| SCHEMBL9860776 | 0.77 | CES1 (0.64) | KMT2ALMNACYP2D6CYP3A4CES1 | |
| SCHEMBL7556087 | 0.77 | KMT2A (0.47) | KMT2AMAPTLMNACYP2D6CYP3A4 | |
| SCHEMBL8938100 | 0.76 | MAPT (0.50) | KMT2AMAPTLMNACYP2D6CYP3A4 | |
| SCHEMBL4561507 | 0.76 | CYP2D6 (0.50) | KMT2AMAPTLMNACYP2D6CYP3A4 | |
| SCHEMBL5982853 | 0.75 | CES1 (0.43) | KMT2AMAPTLMNACYP2D6CYP3A4 |
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-0649418-A1 | 7-(2-AMINOETHYL)-BENZOTHIAZOLONES | Astra Pharmaceuticals Limited (GB) | 1995-04-26 | — | — | EP | disclosed |
| WO-1993024473-A1 | 7-(2-AMINOETHYL)-BENZOTHIAZOLONES | FISONS PLC (GB) | 1993-12-09 | — | — | WO | disclosed |